Geometry & MOs

Info

ID:

184853

PubChem CID:

77221212

Reduced:

NO3C11H15 (1)

Stoich.:

AB3C11D15 (1)

Weight, g/mol:

209.105193

ΔHf, kcal/mol:

-128.77

Dipole, Da:

2.38

IP(EA), eV:

-9.52(0.17)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(3-hydroxy-4-phenylbutan-2-yl) carbamate

Drug info:

PubChemData

Smile

CC(CC1=CC=CC=C1)(CO)OC(=O)N

DOS

IR

Vibrations