Geometry & MOs

Info

ID:	305958
PubChem CID:	124976042
Reduced:	O2N5C23H31 (1)
Stoich.:	A2B5C23D31 (1)
Weight, g/mol:	421.18017
ΔH_f, kcal/mol:	-49.33
Dipole, Da:	3.26
IP(EA), eV:	-8.92(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(6S)-10-(7-fluoro-1H-indole-2-carbonyl)-4-phenyl-1-oxa-4,10-diazaspiro[5.6]dodecan-3-one

Drug info:

PubChemData

Smile

CC1=CC(=NC=N1)N2CCC[C@@](C2)(CNC(=O)CCCN3CC4=CC=CC=C4C3)O

DOS

IR

Vibrations