Geometry & MOs

Info

ID:	290830
PubChem CID:	111123599
Reduced:	IO2N4C18H31 (1)
Stoich.:	AB2C4D18E31 (1)
Weight, g/mol:	314.108899
ΔH_f, kcal/mol:	-58.87
Dipole, Da:	4.22
IP(EA), eV:	-8.87(0.44)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-phenylmethoxy-3-(2-thiophen-2-ylimidazol-1-yl)propan-2-ol

Drug info:

PubChemData

Smile

CC(C1=CC=CC=C1)NC2(CCOCC2)CN=C(N)NCCOC.I

DOS

IR

Vibrations