Geometry & MOs

Info

ID:	207068
PubChem CID:	80342164
Reduced:	ON3C13H19 (1)
Stoich.:	AB3C13D19 (1)
Weight, g/mol:	251.163377
ΔH_f, kcal/mol:	-12.9
Dipole, Da:	3.82
IP(EA), eV:	-8.8(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[[4-(1-hydroxyethyl)pyridin-2-yl]-methylamino]-N-propan-2-ylacetamide

Drug info:

PubChemData

Smile

C[C@@H](C1=CC(=NC=C1)N(CCC#N)C(C)C)O

DOS

IR

Vibrations