Geometry & MOs

Info

ID:	5253
PubChem CID:	12839
Reduced:	ClNO2C10H12 (1)
Stoich.:	ABC2D10E12 (1)
Weight, g/mol:	213.055656
ΔH_f, kcal/mol:	-91.78
Dipole, Da:	2.23
IP(EA), eV:	-9.47(-0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-chlorophenyl)propan-2-yl carbamate

Drug info:

PubChemData

Smile

CC(CC1=CC=CC=C1Cl)OC(=O)N

DOS

IR

Vibrations