Geometry & MOs

Info

ID:	188068
PubChem CID:	77663737
Reduced:	ClSF2N4O7C22H23 (1)
Stoich.:	ABC2D4E7F22G23 (1)
Weight, g/mol:	538.108911
ΔH_f, kcal/mol:	-343.59
Dipole, Da:	6.53
IP(EA), eV:	-9.22(-1.39)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclobutyl N-[3-[(5-chlorothiophene-2-carbonyl)amino]-1-[2-fluoro-4-(3-oxomorpholin-4-yl)anilino]-1-oxopropan-2-yl]carbamate

Drug info:

PubChemData

Smile

C1COCC(=O)N1C2=C(C=C(C=C2)NC(=O)C(CNC(=O)C3=CC=C(S3)Cl)NC(=O)OCCO)C(F)F

DOS

IR

Vibrations