Geometry & MOs

Info

ID:	368727
PubChem CID:	127329946
Reduced:	O2N3C16H29 (1)
Stoich.:	A2B3C16D29 (1)
Weight, g/mol:	270.176585
ΔH_f, kcal/mol:	-114.12
Dipole, Da:	3.13
IP(EA), eV:	-8.76(1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-propan-2-yl-N-(thian-4-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CN2CCCCC2CN1C(=O)NCC3CCOCC3

DOS

IR

Vibrations