Geometry & MOs

Info

ID:	169785
PubChem CID:	75148191
Reduced:	N4O5C23H30 (1)
Stoich.:	A4B5C23D30 (1)
Weight, g/mol:	476.166684
ΔH_f, kcal/mol:	-171.48
Dipole, Da:	3.49
IP(EA), eV:	-9.36(-1.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

8-[[3-(2-chlorophenyl)-4-hydroxyphenyl]methyl]-1-(3-fluorophenyl)-7-methyl-1,8-diazaspiro[4.5]dec-3-en-2-one

Drug info:

PubChemData

Smile

CC(C)C(C(=O)NC)NC(=O)C1=CC=C(O1)C2=CC=CC(=C2)CNC(=O)C3COCCN3

DOS

IR

Vibrations