Geometry & MOs

Info

ID:	422074
PubChem CID:	135117134
Reduced:	NOC4H6 (4)
Stoich.:	ABC4D6 (4)
Weight, g/mol:	414.172562
ΔH_f, kcal/mol:	-152.4
Dipole, Da:	5.77
IP(EA), eV:	-9.22(-0.43)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-oxo-3-(2-phenylspiro[5,6-dihydrocyclopenta[d]pyrimidine-7,3'-piperidine]-1'-yl)propyl]methanesulfonamide

Drug info:

PubChemData

Smile

CCC1=CC(=NC(=N1)N2CCOCC2)NC3(CCOCC3)C(=O)O

DOS

IR

Vibrations