Geometry & MOs

Info

ID:	23460
PubChem CID:	603825
Reduced:	ON2C16H20 (1)
Stoich.:	AB2C16D20 (1)
Weight, g/mol:	256.157563
ΔH_f, kcal/mol:	-6.22
Dipole, Da:	2.38
IP(EA), eV:	-8.32(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-methyl-1-[4-(methylamino)-1,3,4,5-tetrahydrobenzo[cd]indol-5-yl]prop-2-en-1-ol

Drug info:

PubChemData

Smile

CC(=C)C(C1C(CC2=CNC3=CC=CC1=C23)NC)O

DOS

IR

Vibrations