Geometry & MOs

Info

ID:	425194
PubChem CID:	135125495
Reduced:	FO2N4C23H25 (1)
Stoich.:	AB2C4D23E25 (1)
Weight, g/mol:	336.183778
ΔH_f, kcal/mol:	-53.18
Dipole, Da:	2.95
IP(EA), eV:	-8.11(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6-pyridin-3-ylspiro[3,4-dihydrochromene-2,4'-piperidine]-1'-yl)propan-1-one

Drug info:

PubChemData

Smile

C[C@H]1C[C@H](C2=C(N1C(=O)C)C=CC(=C2)C3=NN(C=C3)C)NC4=C(C=C(C=C4)F)OC

DOS

IR

Vibrations