Geometry & MOs

Info

ID:	272563
PubChem CID:	103747109
Reduced:	NO2C17H31 (1)
Stoich.:	AB2C17D31 (1)
Weight, g/mol:	284.06532
ΔH_f, kcal/mol:	-152.12
Dipole, Da:	4.93
IP(EA), eV:	-9.6(1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,4-dithian-2-ylmethyl)-6-methyl-4-oxo-1H-pyridine-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)CC1(CCCC1)C(=O)NCC2CCCC(C2)O

DOS

IR

Vibrations