Geometry & MOs

Info

ID:	369552
PubChem CID:	127334574
Reduced:	O3N4C18H24 (1)
Stoich.:	A3B4C18D24 (1)
Weight, g/mol:	297.15896
ΔH_f, kcal/mol:	-90.42
Dipole, Da:	2.48
IP(EA), eV:	-8.06(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1,3-dimethyl-N-(2-propan-2-ylindazol-5-yl)pyrazole-4-carboxamide

Drug info:

PubChemData

Smile

CC(C)N1C=C2C=C(C=CC2=N1)NC(=O)CCC(=O)N3CCOCC3

DOS

IR

Vibrations