Geometry & MOs

Info

ID:	136334
PubChem CID:	52025403
Reduced:	ON5C18H19 (1)
Stoich.:	AB5C18D19 (1)
Weight, g/mol:	358.179361
ΔH_f, kcal/mol:	28.67
Dipole, Da:	6.79
IP(EA), eV:	-8.77(-0.53)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(3,5-dimethyl-1-phenylpyrazol-4-yl)-2-(2-methyl-1H-indol-3-yl)acetamide

Drug info:

PubChemData

Smile

C1CCN([C@H](C1)C2=NC3=CC=CC=C3N2)C(=O)C4=NC=CC(=C4)N

DOS

IR

Vibrations