Geometry & MOs

Info

ID:	67630
PubChem CID:	46506852
Reduced:	ON3H15C18 (1)
Stoich.:	AB3C15D18 (1)
Weight, g/mol:	253.142641
ΔH_f, kcal/mol:	60.59
Dipole, Da:	2.7
IP(EA), eV:	-8.59(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2,2-dimethoxyethyl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxamide

Drug info:

PubChemData

Smile

CCOC1=CC=C(C=C1)C2=NNC3=C2C=NC4=CC=CC=C43

DOS

IR

Vibrations