Geometry & MOs

Info

ID:	415635
PubChem CID:	135088634
Reduced:	SN3O6C16H21 (1)
Stoich.:	AB3C6D16E21 (1)
Weight, g/mol:	328.172168
ΔH_f, kcal/mol:	-210.69
Dipole, Da:	9.73
IP(EA), eV:	-9.14(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,N-dimethyl-1'-(thiophen-3-ylmethyl)spiro[5,6-dihydrocyclopenta[d]pyrimidine-7,3'-piperidine]-2-amine

Drug info:

PubChemData

Smile

CN(C)S(=O)(=O)C[C@@H]1COC[C@@H]1NC(=O)CN2C3=CC=CC=C3OC2=O

DOS

IR

Vibrations