Geometry & MOs

Info

ID:	347427
PubChem CID:	127272276
Reduced:	N3O3C22H33 (1)
Stoich.:	A3B3C22D33 (1)
Weight, g/mol:	372.173231
ΔH_f, kcal/mol:	-130.3
Dipole, Da:	5.08
IP(EA), eV:	-8.77(0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-pyrimidin-2-ylpiperidin-3-yl)-4-(1,3-thiazol-2-yl)piperidine-1-carboxamide

Drug info:

PubChemData

Smile

CC1CN(CC(O1)C)CC2CCN(CC2)C(=O)NC3CC4=CC=CC=C4OC3

DOS

IR

Vibrations