Geometry & MOs

Info

ID:	254582
PubChem CID:	103126312
Reduced:	N3C7H9 (2)
Stoich.:	A3B7C9 (2)
Weight, g/mol:	283.179696
ΔH_f, kcal/mol:	108.69
Dipole, Da:	4.19
IP(EA), eV:	-8.98(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(1-methylindazol-3-yl)-(1-methylpyrazol-4-yl)methyl]propan-1-amine

Drug info:

PubChemData

Smile

CCCN1C=C(C=N1)C(C2=C3C=NC=CN3N=C2)NC

DOS

IR

Vibrations