Geometry & MOs

Info

ID:

29871

PubChem CID:

837922

Reduced:

O2N3C16H21 (1)

Stoich.:

A2B3C16D21 (1)

Weight, g/mol:

193.110279

ΔHf, kcal/mol:

-46.2

Dipole, Da:

3.0

IP(EA), eV:

-8.62(-0.34)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

(2R)-N-(4-hydroxyphenyl)-2-methylbutanamide

Drug info:

PubChemData

Smile

CC[C@H](C)C(=O)NC1=C(N(N(C1=O)C2=CC=CC=C2)C)C

DOS

IR

Vibrations