Geometry & MOs

Info

ID:	269704
PubChem CID:	103618705
Reduced:	N2S2O3C12H12 (1)
Stoich.:	A2B2C3D12E12 (1)
Weight, g/mol:	330.99747
ΔH_f, kcal/mol:	-81.04
Dipole, Da:	2.24
IP(EA), eV:	-8.82(-1.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-5-chloro-N-cyclopropyl-N-(2-methoxyethyl)benzamide

Drug info:

PubChemData

Smile

CCOC(=O)C1=C(SC(=C1)C)NC(=O)C2=CN=CS2

DOS

IR

Vibrations