Geometry & MOs

Info

ID:	181239
PubChem CID:	76719818
Reduced:	N2C10H11 (2)
Stoich.:	A2B10C11 (2)
Weight, g/mol:	246.100442
ΔH_f, kcal/mol:	66.22
Dipole, Da:	3.41
IP(EA), eV:	-8.66(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-(6-methoxy-1H-indazol-3-yl)prop-2-enoate

Drug info:

PubChemData

Smile

CC1=NC=C(C=C1)C2=CC3=C(C=C2)N4CCN5CCCC5CC4=N3

DOS

IR

Vibrations