Geometry & MOs

Info

ID:	105123
PubChem CID:	50106422
Reduced:	N3O3C14H18 (2)
Stoich.:	A3B3C14D18 (2)
Weight, g/mol:	499.198632
ΔH_f, kcal/mol:	-234.56
Dipole, Da:	5.74
IP(EA), eV:	-8.24(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(4-carbamoyl-2-methylanilino)-2-oxoethyl]-N-[3-(2-chloroanilino)-3-oxopropyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=C(C=CC(=C1)C(=O)N)NC(=O)CN2CCC(CC2)C(=O)NC(C)C(=O)NC3=CC(=C(C=C3)OC)NC(=O)C

DOS

IR

Vibrations