Geometry & MOs

Info

ID:	177722
PubChem CID:	76220955
Reduced:	ClN2C9H13 (1)
Stoich.:	AB2C9D13 (1)
Weight, g/mol:	179.142248
ΔH_f, kcal/mol:	2.86
Dipole, Da:	3.46
IP(EA), eV:	-9.22(-0.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4,5,6,7-tetrahydro-1H-indol-2-yl)ethane-1,2-diamine

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C(CN)N)Cl

DOS

IR

Vibrations