Geometry & MOs

Info

ID:	371549
PubChem CID:	127347097
Reduced:	ON5C19H33 (1)
Stoich.:	AB5C19D33 (1)
Weight, g/mol:	396.252526
ΔH_f, kcal/mol:	-37.18
Dipole, Da:	7.84
IP(EA), eV:	-8.49(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[2-[3-(pyrrolidin-1-ylmethyl)pyrrolidin-1-yl]acetyl]spiro[1H-quinoxaline-3,1'-cyclopentane]-2-one

Drug info:

PubChemData

Smile

CC1=NN(C(=C1)NC(=O)CN2CCC(C2)CN3CCCC3)C(C)(C)C

DOS

IR

Vibrations