Geometry & MOs

Info

ID:	209392
PubChem CID:	80664813
Reduced:	ClN2O2C8H11 (1)
Stoich.:	AB2C2D8E11 (1)
Weight, g/mol:	305.02268
ΔH_f, kcal/mol:	-92.7
Dipole, Da:	1.99
IP(EA), eV:	-9.72(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bromopropyl)-2-(2,4-difluorophenyl)-N-methylacetamide

Drug info:

PubChemData

Smile

CCC1=C(N=C(NC1=O)C(C)Cl)O

DOS

IR

Vibrations