Geometry & MOs

Info

ID:	414591
PubChem CID:	135087550
Reduced:	N2O3C22H24 (1)
Stoich.:	A2B3C22D24 (1)
Weight, g/mol:	239.163377
ΔH_f, kcal/mol:	-56.52
Dipole, Da:	5.44
IP(EA), eV:	-9.64(-0.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(2-methyl-1H-imidazol-5-yl)methyl-(oxolan-3-ylmethyl)amino]ethanol

Drug info:

PubChemData

Smile

CC(C)(C#CC1=CC(=CC=C1)C(=O)N2C[C@H]([C@H](C2)O)CC3=CC=NC=C3)O

DOS

IR

Vibrations