Geometry & MOs

Info

ID:	296290
PubChem CID:	117566439
Reduced:	BrN2O3C8H13 (1)
Stoich.:	AB2C3D8E13 (1)
Weight, g/mol:	197.024356
ΔH_f, kcal/mol:	-141.9
Dipole, Da:	3.14
IP(EA), eV:	-9.86(-0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-acetylphenyl)carbamoyl chloride

Drug info:

PubChemData

Smile

CCOC(=O)N1CCN(CC1)C(=O)Br

DOS

IR

Vibrations