Geometry & MOs

Info

ID:	274142
PubChem CID:	103807317
Reduced:	O2N3C10H17 (1)
Stoich.:	A2B3C10D17 (1)
Weight, g/mol:	315.9978
ΔH_f, kcal/mol:	-78.7
Dipole, Da:	2.82
IP(EA), eV:	-9.63(0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-amino-1-cyclopropylethyl)-2-bromo-5-chlorobenzamide

Drug info:

PubChemData

Smile

C1CC(=O)N[C@@H]1C(=O)NC(CN)C2CC2

DOS

IR

Vibrations