Geometry & MOs

Info

ID:	256316
PubChem CID:	103138421
Reduced:	SN3C17H19 (1)
Stoich.:	AB3C17D19 (1)
Weight, g/mol:	206.116761
ΔH_f, kcal/mol:	55.78
Dipole, Da:	2.62
IP(EA), eV:	-7.76(-0.52)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,5-dimethylpyrazol-3-yl)-(1-methylpyrazol-3-yl)methanol

Drug info:

PubChemData

Smile

CC1=CC=C(S1)CC(C)NC2=C3C=NC=CC3=C(C=C2)N

DOS

IR

Vibrations