Geometry & MOs

Info

ID:	118154
PubChem CID:	50631062
Reduced:	ClO4N5C30H32 (1)
Stoich.:	AB4C5D30E32 (1)
Weight, g/mol:	609.167638
ΔH_f, kcal/mol:	-112.98
Dipole, Da:	4.35
IP(EA), eV:	-9.02(-0.82)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-[4-chloro-3-(diethylcarbamoyl)anilino]-2-oxoethyl]-N-[3-(2,3-dichloroanilino)-3-oxopropyl]piperidine-4-carboxamide

Drug info:

PubChemData

Smile

CN(C)C(=O)C1=CC(=C(C=C1)Cl)NC(=O)CN2CCC(CC2)C(=O)NC3=CC=CC=C3C(=O)NC4=CC=CC=C4

DOS

IR

Vibrations