Geometry & MOs

Info

ID:	418827
PubChem CID:	135106932
Reduced:	NSO2C17H25 (1)
Stoich.:	ABC2D17E25 (1)
Weight, g/mol:	400.156912
ΔH_f, kcal/mol:	-101.91
Dipole, Da:	4.05
IP(EA), eV:	-9.0(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=CC(=CC(=C1)CSCC(=O)NCC2CCCOC2)C

DOS

IR

Vibrations