Geometry & MOs

Info

ID:	358527
PubChem CID:	127296123
Reduced:	ON4C22H32 (1)
Stoich.:	AB4C22D32 (1)
Weight, g/mol:	297.187484
ΔH_f, kcal/mol:	-31.65
Dipole, Da:	3.13
IP(EA), eV:	-8.24(0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-piperidin-1-yl-N-(thian-4-yl)pyrrolidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)C(=CN2)CCNC(=O)N3CCCCC(C3)N4CCCC4

DOS

IR

Vibrations