Geometry & MOs

Info

ID:	71107
PubChem CID:	48414296
Reduced:	O2N5C23H23 (1)
Stoich.:	A2B5C23D23 (1)
Weight, g/mol:	361.153875
ΔH_f, kcal/mol:	63.91
Dipole, Da:	2.56
IP(EA), eV:	-9.65(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-methyl-1-(3-phenyl-1,2,4-oxadiazol-5-yl)propyl]-1H-indazole-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)C(C1=NC(=NO1)C2=CC=CC=C2)NC(=O)C3=CC=C(C=C3)CN4C=CC=N4

DOS

IR

Vibrations