Geometry & MOs

Info

ID:	131779
PubChem CID:	51260693
Reduced:	OS2N3C13H15 (1)
Stoich.:	AB2C3D13E15 (1)
Weight, g/mol:	382.101896
ΔH_f, kcal/mol:	44.26
Dipole, Da:	2.93
IP(EA), eV:	-9.1(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,3-diphenylpyrazol-4-yl)-N-(1,3-thiazol-4-ylmethyl)methanamine;hydrochloride

Drug info:

PubChemData

Smile

C=CCN(CC1=CC=CS1)CC(=O)NC2=NC=CS2

DOS

IR

Vibrations