Geometry & MOs

Info

ID:	403771
PubChem CID:	135061785
Reduced:	N3C23H31 (1)
Stoich.:	A3B23C31 (1)
Weight, g/mol:	431.188529
ΔH_f, kcal/mol:	64.92
Dipole, Da:	2.18
IP(EA), eV:	-7.66(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[(R)-[4-(2,3-dihydro-1,4-benzodioxin-6-yl)phenyl]-phenylmethyl]-1-methylindole

Drug info:

PubChemData

Smile

CC(C)C1=C(C(=CC=C1)C(C)C)[N+]2=CC(=[N+](N2)C(C)C)C3=CC=CC=C3

DOS

IR

Vibrations