Geometry & MOs

Info

ID:	306115
PubChem CID:	125001669
Reduced:	O3N4C21H22 (1)
Stoich.:	A3B4C21D22 (1)
Weight, g/mol:	368.190006
ΔH_f, kcal/mol:	-12.8
Dipole, Da:	4.23
IP(EA), eV:	-9.24(-1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5S)-3-benzyl-9-[(4-fluorophenyl)methyl]-1-oxa-3,9-diazaspiro[4.6]undecan-2-one

Drug info:

PubChemData

Smile

CC1=C(C(=NO1)C)C2=CN=CC(=N2)[C@@H]3CCCN3C(=O)C4=CC(=CC=C4)OC

DOS

IR

Vibrations