Geometry & MOs

Info

ID:	373523
PubChem CID:	131316489
Reduced:	ON3C8H13 (1)
Stoich.:	AB3C8D13 (1)
Weight, g/mol:	223.168462
ΔH_f, kcal/mol:	-18.0
Dipole, Da:	3.69
IP(EA), eV:	-9.39(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(2-aminoethyl)-2,5,5-trimethyl-6,7-dihydroindazol-4-ol

Drug info:

PubChemData

Smile

CC1C(=NNC1=O)C2CCCN2

DOS

IR

Vibrations