Geometry & MOs

Info

ID:	396275
PubChem CID:	135027901
Reduced:	OC7H8 (2)
Stoich.:	AB7C8 (2)
Weight, g/mol:	340.0171
ΔH_f, kcal/mol:	-53.63
Dipole, Da:	4.76
IP(EA), eV:	-8.0(0.14)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1R,9S,10R,14S)-3-bromo-14-hydroxy-13-methyl-2,8,11,13-tetrazatetracyclo[7.6.0.02,6.010,14]pentadeca-3,5-diene-7,12-dione

Drug info:

PubChemData

Smile

CCOC1=CC(=C(CC1)C2=CC=CC=C2)O

DOS

IR

Vibrations