Geometry & MOs

Info

ID:	28984
PubChem CID:	830994
Reduced:	OSN4C17H22 (1)
Stoich.:	ABC4D17E22 (1)
Weight, g/mol:	266.178299
ΔH_f, kcal/mol:	4.79
Dipole, Da:	6.44
IP(EA), eV:	-7.98(-0.08)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-3-(4-aminophenyl)-1,1,3-trimethyl-2H-inden-5-amine

Drug info:

PubChemData

Smile

C1CN(CCC1C(=O)N)CN2C=CN(C2=S)CC3=CC=CC=C3

DOS

IR

Vibrations