Geometry & MOs

Info

ID:	175752
PubChem CID:	75943191
Reduced:	N3O3C26H31 (1)
Stoich.:	A3B3C26D31 (1)
Weight, g/mol:	380.99313
ΔH_f, kcal/mol:	-87.76
Dipole, Da:	2.94
IP(EA), eV:	-8.14(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(3-bromophenyl)-N-[(3-chloro-4-fluorophenyl)methyl]cyclopropane-1-carboxamide

Drug info:

PubChemData

Smile

CCCC(C(=O)NC1=CC(=CC=C1)N2CCCC2)NC(=O)C3=C(C4=CC=CC(=C4O3)C)C

DOS

IR

Vibrations