Geometry & MOs

Info

ID:	420751
PubChem CID:	135114762
Reduced:	OSN4C16H18 (1)
Stoich.:	ABC4D16E18 (1)
Weight, g/mol:	303.158292
ΔH_f, kcal/mol:	26.27
Dipole, Da:	4.37
IP(EA), eV:	-8.61(-0.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-hydroxyethyl)-N-[(2-methyl-1H-imidazol-5-yl)methyl]-3-phenoxypropanamide

Drug info:

PubChemData

Smile

CC1=CC(=NN1)C[C@@H]2CN(C[C@H]2O)C3=NC4=CC=CC=C4S3

DOS

IR

Vibrations