Geometry & MOs

Info

ID:	170163
PubChem CID:	75205089
Reduced:	ClN2O2C21H21 (1)
Stoich.:	AB2C2D21E21 (1)
Weight, g/mol:	370.149284
ΔH_f, kcal/mol:	-23.42
Dipole, Da:	2.7
IP(EA), eV:	-9.66(-1.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopropyl-4-[3-[1-(3,4-difluorophenyl)ethylamino]-3-oxoprop-1-enyl]benzamide

Drug info:

PubChemData

Smile

CC(C1=CC(=CC=C1)Cl)NC(=O)C=CC2=CC=C(C=C2)C(=O)NC3CC3

DOS

IR

Vibrations