Geometry & MOs

Info

ID:	255846
PubChem CID:	103135164
Reduced:	O3C15H22 (1)
Stoich.:	A3B15C22 (1)
Weight, g/mol:	219.148396
ΔH_f, kcal/mol:	-137.4
Dipole, Da:	3.85
IP(EA), eV:	-8.52(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1,5-dimethylpyrazol-4-yl)-N-methyl-1-(1-methylpyrazol-3-yl)methanamine

Drug info:

PubChemData

Smile

CC1CCC(O1)COC2=C(C=C(C=C2)C)[C@H](C)O

DOS

IR

Vibrations