Geometry & MOs

Info

ID:	67368
PubChem CID:	46506360
Reduced:	N3O3H23C25 (1)
Stoich.:	A3B3C23D25 (1)
Weight, g/mol:	477.0688
ΔH_f, kcal/mol:	-65.11
Dipole, Da:	4.86
IP(EA), eV:	-8.55(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3-bromophenyl)-3-(9-methyl-11-oxo-8-oxa-10,12-diazatricyclo[7.3.1.02,7]trideca-2,4,6-trien-10-yl)benzamide

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)NC(=O)C2=CC(=CC=C2)N3C(=O)NC4CC3(OC5=CC=CC=C45)C

DOS

IR

Vibrations