Geometry & MOs

Info

ID:	419786
PubChem CID:	135109059
Reduced:	NO2C24H29 (1)
Stoich.:	AB2C24D29 (1)
Weight, g/mol:	336.161997
ΔH_f, kcal/mol:	-64.83
Dipole, Da:	4.76
IP(EA), eV:	-9.22(-0.13)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(dimethylamino)ethyl]-N-[(5-methyl-1H-imidazol-4-yl)methyl]-5-(methylsulfanylmethyl)furan-2-carboxamide

Drug info:

PubChemData

Smile

CC1=CC=CC=C1C2=CC=C(C=C2)C(=O)N3CCC[C@@]4(C3)CCC[C@H]4OC

DOS

IR

Vibrations