Geometry & MOs

Info

ID:	145906
PubChem CID:	53609670
Reduced:	ON5C18H25 (1)
Stoich.:	AB5C18D25 (1)
Weight, g/mol:	296.174945
ΔH_f, kcal/mol:	0.14
Dipole, Da:	8.17
IP(EA), eV:	-8.3(-0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-methylpyrazol-1-yl)-N-[(1-methyl-3-pyridin-3-ylpyrazol-4-yl)methyl]ethanamine

Drug info:

PubChemData

Smile

CC1=C(C(=NN1C(C)C)C)NC(=O)C2=CN=C(C=C2)N3CCCC3

DOS

IR

Vibrations