Geometry & MOs

Info

ID:	392022
PubChem CID:	135012016
Reduced:	NO5C18H19 (1)
Stoich.:	AB5C18D19 (1)
Weight, g/mol:	392.173607
ΔH_f, kcal/mol:	-165.46
Dipole, Da:	1.42
IP(EA), eV:	-8.9(-0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S,6S,8E,12S,16S)-10-methyl-14-phenyl-8-propylidene-4-oxa-2,14-diazatetracyclo[7.7.0.02,6.012,16]hexadec-9-ene-3,13,15-trione

Drug info:

PubChemData

Smile

COC1=CC=C(C=C1)COC(=O)CNC(=O)OCC2=CC=CC=C2

DOS

IR

Vibrations