Geometry & MOs

Info

ID:

290511

PubChem CID:

104643407

Reduced:

O2N3C9H21 (1)

Stoich.:

A2B3C9D21 (1)

Weight, g/mol:

217.142641

ΔHf, kcal/mol:

-101.4

Dipole, Da:

4.0

IP(EA), eV:

-8.84(0.96)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

4-(3-amino-2-hydroxypropyl)-N-methylmorpholine-3-carboxamide

Drug info:

PubChemData

Smile

CCN(CC(CN)O)CC(=O)N(C)C

DOS

IR

Vibrations