Geometry & MOs

Info

ID:	207754
PubChem CID:	80444659
Reduced:	SN4C16H30 (1)
Stoich.:	AB4C16D30 (1)
Weight, g/mol:	236.188863
ΔH_f, kcal/mol:	-6.59
Dipole, Da:	3.23
IP(EA), eV:	-8.58(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[3-methyl-2-(propylamino)pentyl]pyridin-2-one

Drug info:

PubChemData

Smile

CCC(C)C1=C(SC(=N1)N(C)C2CCN(CC2)CC)CN

DOS

IR

Vibrations