Geometry & MOs

Info

ID:	418232
PubChem CID:	135103922
Reduced:	SN3O4C15H15 (1)
Stoich.:	AB3C4D15E15 (1)
Weight, g/mol:	353.173942
ΔH_f, kcal/mol:	-96.87
Dipole, Da:	9.37
IP(EA), eV:	-9.2(-1.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1=C(SC2=NC=NC(=C12)N3C[C@]4(C[C@]4(C3)C(=O)O)C(=O)O)C

DOS

IR

Vibrations