Geometry & MOs

Info

ID:	157563
PubChem CID:	56435709
Reduced:	ClN3O4C23H28 (1)
Stoich.:	AB3C4D23E28 (1)
Weight, g/mol:	389.191483
ΔH_f, kcal/mol:	-154.23
Dipole, Da:	6.96
IP(EA), eV:	-9.41(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[4-(dimethylamino)-3,5-difluoroanilino]-2-oxo-1-phenylethyl]-3-methylbutanamide

Drug info:

PubChemData

Smile

CC(C)CC(=O)NC(C1=CC=CC=C1)C(=O)NC2=CC(=C(C=C2)C(=O)NCCOC)Cl

DOS

IR

Vibrations