Geometry & MOs

Info

ID:	105303
PubChem CID:	50106865
Reduced:	O4N5C26H33 (1)
Stoich.:	A4B5C26D33 (1)
Weight, g/mol:	525.258734
ΔH_f, kcal/mol:	-154.7
Dipole, Da:	11.03
IP(EA), eV:	-8.9(-0.3)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(4-carbamoyl-2-methylanilino)-2-oxoethyl]-N-[3-(2,5-dimethoxyanilino)-3-oxopropyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CC1=CC(=CC=C1)NC(=O)CCNC(=O)C2CCN(CC2)CC(=O)NC3=C(C=C(C=C3)C(=O)N)C

DOS

IR

Vibrations