Geometry & MOs

Info

ID:	415077
PubChem CID:	135088063
Reduced:	NO5C20H29 (1)
Stoich.:	AB5C20D29 (1)
Weight, g/mol:	327.158292
ΔH_f, kcal/mol:	-222.67
Dipole, Da:	2.87
IP(EA), eV:	-8.51(0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4,6-dimethyl-2-oxo-N-[(3S,4S)-4-(pyridin-4-ylmethyl)oxolan-3-yl]-1H-pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC1(CCOC2(C1)CCN(CC2)C(=O)CC3=C(C=C(C=C3)OC)OC)O

DOS

IR

Vibrations