Geometry & MOs

Info

ID:	197859
PubChem CID:	79007328
Reduced:	NO2C16H25 (1)
Stoich.:	AB2C16D25 (1)
Weight, g/mol:	265.157898
ΔH_f, kcal/mol:	-91.51
Dipole, Da:	3.4
IP(EA), eV:	-9.09(0.62)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1-phenylbutan-2-yl)-1H-indazol-7-amine

Drug info:

PubChemData

Smile

CCC(CC1=CC=CC=C1)N[C@@H](C(C)C)C(=O)OC

DOS

IR

Vibrations