Geometry & MOs

Info

ID:	418516
PubChem CID:	135105426
Reduced:	FO3N4C16H19 (1)
Stoich.:	AB3C4D16E19 (1)
Weight, g/mol:	450.17102
ΔH_f, kcal/mol:	-78.25
Dipole, Da:	4.61
IP(EA), eV:	-9.64(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-(4-chlorophenyl)quinolin-4-yl]-(4-hydroxy-4-methyl-1-oxa-9-azaspiro[5.5]undecan-9-yl)methanone

Drug info:

PubChemData

Smile

COCCC1=NOC(=N1)CN2CCNC(=O)C2C3=CC=C(C=C3)F

DOS

IR

Vibrations