Geometry & MOs

Info

ID:	340195
PubChem CID:	127262204
Reduced:	ClNO3H8C11 (1)
Stoich.:	ABC3D8E11 (1)
Weight, g/mol:	223.076392
ΔH_f, kcal/mol:	-62.44
Dipole, Da:	4.1
IP(EA), eV:	-10.28(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(NZ)-N-(2,2-dimethyl-1-phenylpropylidene)carbamoyl chloride

Drug info:

PubChemData

Smile

CC(=O)/C(=N\C(=O)Cl)/C(=O)C1=CC=CC=C1

DOS

IR

Vibrations