Geometry & MOs

Info

ID:	253999
PubChem CID:	103122082
Reduced:	O2N4C15H22 (1)
Stoich.:	A2B4C15D22 (1)
Weight, g/mol:	227.105862
ΔH_f, kcal/mol:	-61.38
Dipole, Da:	6.06
IP(EA), eV:	-10.33(-0.6)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N,1-dimethyl-N-prop-2-ynylindazole-3-carboxamide

Drug info:

PubChemData

Smile

C1C2CC3CC1CC(C2)(C3)CN4C(=C(N=N4)C(=O)O)CN

DOS

IR

Vibrations