Geometry & MOs

Info

ID:	49022
PubChem CID:	11528624
Reduced:	FNOH12C13 (1)
Stoich.:	ABCD12E13 (1)
Weight, g/mol:	217.146664
ΔH_f, kcal/mol:	-29.62
Dipole, Da:	5.22
IP(EA), eV:	-9.1(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,5,7-trimethylspiro[3,4-dihydroquinoline-2,1'-cyclopropane]-6-ol

Drug info:

PubChemData

Smile

CC1(COC2=C(C=C(C=C2)F)C(=C1)C#N)C

DOS

IR

Vibrations