Geometry & MOs

Info

ID:	266546
PubChem CID:	103570263
Reduced:	ON3C11H21 (1)
Stoich.:	AB3C11D21 (1)
Weight, g/mol:	226.179361
ΔH_f, kcal/mol:	-33.72
Dipole, Da:	0.82
IP(EA), eV:	-8.95(0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[2-(dimethylamino)ethylamino]-2-(1-ethylpyrazol-4-yl)ethanol

Drug info:

PubChemData

Smile

CCC(C)NC(CO)C1=CN(N=C1)CC

DOS

IR

Vibrations