Geometry & MOs

Info

ID:	194858
PubChem CID:	78598034
Reduced:	NO3C17H21 (1)
Stoich.:	AB3C17D21 (1)
Weight, g/mol:	412.320212
ΔH_f, kcal/mol:	-97.86
Dipole, Da:	1.29
IP(EA), eV:	-9.0(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-cyclohexyl-N-[(1-ethylpyrrolidin-2-yl)methyl]-N-[(3-phenylpyrazolidin-4-yl)methyl]acetamide

Drug info:

PubChemData

Smile

CC(C)N(CC1=CC2=CC=CC=C2O1)C(=O)C3CCCO3

DOS

IR

Vibrations