Geometry & MOs

Info

ID:	185419
PubChem CID:	77298801
Reduced:	O6H26C27 (1)
Stoich.:	A6B26C27 (1)
Weight, g/mol:	507.10452
ΔH_f, kcal/mol:	-190.72
Dipole, Da:	3.35
IP(EA), eV:	-8.89(-0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3a-(4-bromophenyl)-1,8b-dihydroxy-N,N,6-trimethyl-3-phenyl-2,3-dihydro-1H-cyclopenta[b][1]benzofuran-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC2=C(C=C1)C3(C(C(C(C3(O2)C4=CC=C(C=C4)OC)C5=CC=CC=C5)C(=O)OC)O)O

DOS

IR

Vibrations