Geometry & MOs

Info

ID:	300065
PubChem CID:	119526658
Reduced:	ClN2O2C16H21 (1)
Stoich.:	AB2C2D16E21 (1)
Weight, g/mol:	272.152478
ΔH_f, kcal/mol:	-80.77
Dipole, Da:	4.52
IP(EA), eV:	-9.35(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]furan-3-carboxamide

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)C(CNC(=O)C2=COC=C2)N.Cl

DOS

IR

Vibrations