Geometry & MOs

Info

ID:	31770
PubChem CID:	3718035
Reduced:	NSO4H15C18 (1)
Stoich.:	ABC4D15E18 (1)
Weight, g/mol:	410.235814
ΔH_f, kcal/mol:	-105.87
Dipole, Da:	8.41
IP(EA), eV:	-8.57(-0.96)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[4-[1-(1H-indol-3-yl)-2-phenylbut-1-enyl]phenoxy]-N,N-dimethylethanamine

Drug info:

PubChemData

Smile

CC(=O)NC1=CC=C(C=C1)S(=O)(=O)OC2=CC3=CC=CC=C3C=C2

DOS

IR

Vibrations