Geometry & MOs

Info

ID:	281612
PubChem CID:	103914119
Reduced:	NSO4C10H23 (1)
Stoich.:	ABC4D10E23 (1)
Weight, g/mol:	227.163377
ΔH_f, kcal/mol:	-196.88
Dipole, Da:	6.26
IP(EA), eV:	-9.32(0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-methoxy-3-[1-(1-methylimidazol-2-yl)ethylamino]butan-1-ol

Drug info:

PubChemData

Smile

CCS(=O)(=O)CC(C)NC(CCO)COC

DOS

IR

Vibrations