Geometry & MOs

Info

ID:	393863
PubChem CID:	135021839
Reduced:	FNC23H30 (1)
Stoich.:	ABC23D30 (1)
Weight, g/mol:	333.157623
ΔH_f, kcal/mol:	-37.44
Dipole, Da:	0.67
IP(EA), eV:	-8.14(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1R,10R,14S,15R,16S)-5,12,12-trimethyl-3-oxo-2,11,13-trioxatetracyclo[7.6.1.04,16.010,14]hexadeca-4,8-dien-15-yl]acetamide

Drug info:

PubChemData

Smile

CCCC[C@@H](CCCC1=CC=C(C=C1)F)CN2CCC3=CC=CC=C32

DOS

IR

Vibrations