Geometry & MOs

Info

ID:	5139
PubChem CID:	12653
Reduced:	ClNO2C10H12 (1)
Stoich.:	ABC2D10E12 (1)
Weight, g/mol:	213.055656
ΔH_f, kcal/mol:	-90.0
Dipole, Da:	3.32
IP(EA), eV:	-8.97(0.01)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-chloro-3,5-dimethylphenyl) N-methylcarbamate

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1Cl)C)OC(=O)NC

DOS

IR

Vibrations