Geometry & MOs

Info

ID:	265480
PubChem CID:	103524732
Reduced:	BrSN2O2C14H17 (1)
Stoich.:	ABC2D2E14F17 (1)
Weight, g/mol:	354.06914
ΔH_f, kcal/mol:	-8.58
Dipole, Da:	4.2
IP(EA), eV:	-8.64(-0.38)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(3-bromo-2,4-dimethoxyphenyl)-(2,5-dimethylpyrazol-3-yl)methyl]hydrazine

Drug info:

PubChemData

Smile

COC1=C(C(=C(C=C1)C(CC2=CSC=C2)NN)OC)Br

DOS

IR

Vibrations