Geometry & MOs

Info

ID:	175647
PubChem CID:	75930630
Reduced:	O2N5C25H27 (1)
Stoich.:	A2B5C25D27 (1)
Weight, g/mol:	445.132382
ΔH_f, kcal/mol:	23.23
Dipole, Da:	6.5
IP(EA), eV:	-9.04(-0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(cyclopropanecarbonyl)-N-[(3,4-dichlorophenyl)methyl]-N-(pyridin-2-ylmethyl)piperidine-3-carboxamide

Drug info:

PubChemData

Smile

C1CC(CN(C1)C(=O)C2CC2)C(=O)NCC3=CN(N=C3C4=CC=NC=C4)C5=CC=CC=C5

DOS

IR

Vibrations