Geometry & MOs

Info

ID:	12689
PubChem CID:	143832
Reduced:	NO2C11H11 (1)
Stoich.:	AB2C11D11 (1)
Weight, g/mol:	189.078979
ΔH_f, kcal/mol:	-29.08
Dipole, Da:	1.81
IP(EA), eV:	-9.06(-0.32)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

phenyl N-buta-1,3-dienylcarbamate

Drug info:

PubChemData

Smile

C=CC=CNC(=O)OC1=CC=CC=C1

DOS

IR

Vibrations