Geometry & MOs

Info

ID:	254621
PubChem CID:	103126565
Reduced:	N3C12H17 (1)
Stoich.:	A3B12C17 (1)
Weight, g/mol:	287.236148
ΔH_f, kcal/mol:	42.58
Dipole, Da:	3.03
IP(EA), eV:	-8.81(-0.67)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-methylindazol-3-yl)-N-propylheptan-1-amine

Drug info:

PubChemData

Smile

CCCCC(C1=C2C=CC=CN2N=C1)N

DOS

IR

Vibrations