Geometry & MOs

Info

ID:	237048
PubChem CID:	92717063
Reduced:	N2O2C21H24 (1)
Stoich.:	A2B2C21D24 (1)
Weight, g/mol:	336.183778
ΔH_f, kcal/mol:	-11.61
Dipole, Da:	3.56
IP(EA), eV:	-9.04(-0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(1S)-1-[1-[2-(2-prop-2-enylphenoxy)ethyl]benzimidazol-2-yl]propan-1-ol

Drug info:

PubChemData

Smile

CC[C@H](C1=NC2=CC=CC=C2N1CCOC3=CC=CC=C3CC=C)O

DOS

IR

Vibrations