Geometry & MOs

Info

ID:	352278
PubChem CID:	127283362
Reduced:	S2O3N4C16H22 (1)
Stoich.:	A2B3C4D16E22 (1)
Weight, g/mol:	267.194677
ΔH_f, kcal/mol:	-112.53
Dipole, Da:	1.46
IP(EA), eV:	-9.1(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[3-(dimethylamino)piperidine-1-carbonyl]pyrrolidin-1-yl]ethanone

Drug info:

PubChemData

Smile

CC1=CN=C(S1)NC(=O)C2CSCN2C(=O)C3CCN(CC3)C(=O)C

DOS

IR

Vibrations