Geometry & MOs

Info

ID:	300059
PubChem CID:	118111090
Reduced:	FSN3O4C27H28 (1)
Stoich.:	ABC3D4E27F28 (1)
Weight, g/mol:	336.160456
ΔH_f, kcal/mol:	-101.79
Dipole, Da:	6.85
IP(EA), eV:	-9.59(-0.68)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]-2,5-dimethylfuran-3-carboxamide;hydrochloride

Drug info:

PubChemData

Smile

CS(=O)(=O)NC(=O)C1=C(C=C(C(=C1)C2CC2)OCC3CN(C3)[C@@H](C4=CC=CC=C4)C5=CC=NC=C5)F

DOS

IR

Vibrations