Geometry & MOs

Info

ID:	5129
PubChem CID:	12636
Reduced:	ClNO2C10H12 (1)
Stoich.:	ABC2D10E12 (1)
Weight, g/mol:	213.055656
ΔH_f, kcal/mol:	-84.96
Dipole, Da:	1.16
IP(EA), eV:	-8.97(-0.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-chloro-3,4-dimethylphenyl) N-methylcarbamate

Drug info:

PubChemData

Smile

CC1=C(C(=C(C=C1)OC(=O)NC)Cl)C

DOS

IR

Vibrations