Geometry & MOs

Info

ID:	130327
PubChem CID:	51075612
Reduced:	ClNSO4C13H18 (1)
Stoich.:	ABCD4E13F18 (1)
Weight, g/mol:	286.135114
ΔH_f, kcal/mol:	-164.05
Dipole, Da:	6.55
IP(EA), eV:	-9.45(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-methylsulfonyl-N,N-bis(prop-2-enyl)piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=C(C=C1)S(=O)(=O)N(C)CCCC(=O)OC)Cl

DOS

IR

Vibrations