Geometry & MOs

Info

ID:	387651
PubChem CID:	134986308
Reduced:	NO2C13H19 (1)
Stoich.:	AB2C13D19 (1)
Weight, g/mol:	333.96229
ΔH_f, kcal/mol:	-59.11
Dipole, Da:	2.93
IP(EA), eV:	-9.9(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-bromo-N-[(4Z)-3-methoxy-4-methylsulfonyliminocyclohexa-2,5-dien-1-ylidene]acetamide

Drug info:

PubChemData

Smile

CCC(C)C1(C=CC(=NC(=O)C)C=C1)OC

DOS

IR

Vibrations