Geometry & MOs

Info

ID:	243203
PubChem CID:	99216883
Reduced:	O3N6C23H30 (1)
Stoich.:	A3B6C23D30 (1)
Weight, g/mol:	372.208279
ΔH_f, kcal/mol:	-77.29
Dipole, Da:	6.65
IP(EA), eV:	-8.55(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2S)-1-[butyl-[(3R)-1,1-dioxothiolan-3-yl]amino]-1-oxopropan-2-yl]cyclohexanecarboxamide

Drug info:

PubChemData

Smile

CN1C2=C(C(=O)N(C1=O)C)N(C=N2)CCCC(=O)N3CCC(CC3)N(C)C4=CC=CC=C4

DOS

IR

Vibrations