Geometry & MOs

Info

ID:	271786
PubChem CID:	103691549
Reduced:	NO2C8H17 (1)
Stoich.:	AB2C8D17 (1)
Weight, g/mol:	198.115698
ΔH_f, kcal/mol:	-112.39
Dipole, Da:	3.83
IP(EA), eV:	-9.02(0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-methylindol-3-yl)methyl]prop-2-yn-1-amine

Drug info:

PubChemData

Smile

CCCNCCCCC(=O)O

DOS

IR

Vibrations