Geometry & MOs

Info

ID:	13476
PubChem CID:	235307
Reduced:	N2O4C11H14 (1)
Stoich.:	A2B4C11D14 (1)
Weight, g/mol:	238.095357
ΔH_f, kcal/mol:	-161.58
Dipole, Da:	1.81
IP(EA), eV:	-8.83(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl N-[3-(methoxycarbonylamino)-4-methylphenyl]carbamate

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations