Geometry & MOs

Info

ID:	271721
PubChem CID:	103689566
Reduced:	IOSN3C10H10 (1)
Stoich.:	ABCD3E10F10 (1)
Weight, g/mol:	231.100777
ΔH_f, kcal/mol:	43.66
Dipole, Da:	1.13
IP(EA), eV:	-8.47(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(1,3-dimethylpyrazol-4-yl)-2-hydroxybenzamide

Drug info:

PubChemData

Smile

CC1=NN(C=C1NC(=O)C2=CSC(=C2)I)C

DOS

IR

Vibrations