Geometry & MOs

Info

ID:	42370
PubChem CID:	8149483
Reduced:	ClO2N3C21H26 (1)
Stoich.:	AB2C3D21E26 (1)
Weight, g/mol:	287.152144
ΔH_f, kcal/mol:	-58.69
Dipole, Da:	7.27
IP(EA), eV:	-8.17(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(3,4-dimethylanilino)-2-oxoethyl] 2-[(1S)-cyclopent-2-en-1-yl]acetate

Drug info:

PubChemData

Smile

C[C@@H](C(=O)NC1=C(C=CC(=C1)Cl)OC)NC2=CC=C(C=C2)N3CCCCC3

DOS

IR

Vibrations