Geometry & MOs

Info

ID:	418915
PubChem CID:	135107113
Reduced:	FSN2O5C15H21 (1)
Stoich.:	ABC2D5E15F21 (1)
Weight, g/mol:	375.20591
ΔH_f, kcal/mol:	-228.74
Dipole, Da:	7.6
IP(EA), eV:	-9.21(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CN(C)S(=O)(=O)C[C@@H]1COC[C@@H]1NC(=O)C2=C(C=C(C=C2)OC)F

DOS

IR

Vibrations