Geometry & MOs

Info

ID:	338143
PubChem CID:	127258835
Reduced:	NO2C12H15 (1)
Stoich.:	AB2C12D15 (1)
Weight, g/mol:	233.141579
ΔH_f, kcal/mol:	-72.65
Dipole, Da:	1.78
IP(EA), eV:	-9.06(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-tert-butylphenyl) N-[(E)-prop-1-enyl]carbamate

Drug info:

PubChemData

Smile

C/C=C/NC(=O)OC1=CC(=CC(=C1)C)C

DOS

IR

Vibrations