Geometry & MOs

Info

ID:	415539
PubChem CID:	135088535
Reduced:	ClN2C18H27 (1)
Stoich.:	AB2C18D27 (1)
Weight, g/mol:	373.166938
ΔH_f, kcal/mol:	-2.5
Dipole, Da:	1.54
IP(EA), eV:	-8.57(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(4-chloro-1-methylpyrrol-2-yl)-[2-(dimethylamino)spiro[5,6-dihydrocyclopenta[d]pyrimidine-7,3'-piperidine]-1'-yl]methanone

Drug info:

PubChemData

Smile

CN(C)C1C[C@@H]2CC(C[C@@H]2C1)N(C)CC3=CC=CC=C3Cl

DOS

IR

Vibrations