Geometry & MOs

Info

ID:	338042
PubChem CID:	127258673
Reduced:	NO2C11H13 (1)
Stoich.:	AB2C11D13 (1)
Weight, g/mol:	221.141579
ΔH_f, kcal/mol:	-54.63
Dipole, Da:	2.12
IP(EA), eV:	-9.51(0.24)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2-methyl-4-phenylpentan-2-yl) carbamate

Drug info:

PubChemData

Smile

C=CC(COC(=O)N)C1=CC=CC=C1

DOS

IR

Vibrations