Geometry & MOs

Info

ID:	176829
PubChem CID:	76103022
Reduced:	Cl2N2O3H4C9 (1)
Stoich.:	A2B2C3D4E9 (1)
Weight, g/mol:	646.268876
ΔH_f, kcal/mol:	-45.86
Dipole, Da:	7.13
IP(EA), eV:	-10.35(-2.85)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-(3,4-dichlorophenyl)-2-methoxyimino-5-[4-(2-oxopiperidin-1-yl)piperidin-1-yl]pentyl]-3,5-dimethoxy-N,4-dimethylbenzamide

Drug info:

PubChemData

Smile

C1=C(C=C(C2=NC(=O)C(N=C21)C(=O)O)Cl)Cl

DOS

IR

Vibrations