Geometry & MOs

Info

ID:	196655
PubChem CID:	78859072
Reduced:	N3O4C24H29 (1)
Stoich.:	A3B4C24D29 (1)
Weight, g/mol:	255.100777
ΔH_f, kcal/mol:	-105.41
Dipole, Da:	2.67
IP(EA), eV:	-8.51(-0.57)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(furan-2-ylmethyl)-5-methyl-1H-indazole-3-carboxamide

Drug info:

PubChemData

Smile

COC1=C(C=C2C(=C1)C(=O)N(C(=N2)CN3CCOCC3)CCCC4=CC=CC=C4)OC

DOS

IR

Vibrations