Geometry & MOs

Info

ID:	414655
PubChem CID:	135087614
Reduced:	OSN4C16H22 (1)
Stoich.:	ABC4D16E22 (1)
Weight, g/mol:	378.118418
ΔH_f, kcal/mol:	18.73
Dipole, Da:	3.41
IP(EA), eV:	-8.81(0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-1'-thiophen-2-ylsulfonylspiro[5,6-dihydrocyclopenta[d]pyrimidine-7,3'-piperidine]-2-amine

Drug info:

PubChemData

Smile

CCN1C(=NC=N1)CN2CCC3(CC2)C4=C(CCO3)SC=C4

DOS

IR

Vibrations