Geometry & MOs

Info

ID:	352798
PubChem CID:	127283887
Reduced:	ON2C10H15 (2)
Stoich.:	AB2C10D15 (2)
Weight, g/mol:	397.239913
ΔH_f, kcal/mol:	-95.17
Dipole, Da:	2.59
IP(EA), eV:	-8.48(0.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-cyclopentyl-N-(1,1-dioxothiolan-3-yl)-2-[2-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]acetamide

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)NC(=O)CN2CCCC2CN3CCCC3)C

DOS

IR

Vibrations