Geometry & MOs

Info

ID:	140246
PubChem CID:	52669594
Reduced:	ClNO3H20C21 (1)
Stoich.:	ABC3D20E21 (1)
Weight, g/mol:	383.05209
ΔH_f, kcal/mol:	-61.23
Dipole, Da:	1.19
IP(EA), eV:	-9.05(-0.28)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-(2-bromophenyl)-N-[(S)-furan-2-yl(phenyl)methyl]propanamide

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)[C@H](C2=CC=CO2)NC(=O)CCCOC3=CC=C(C=C3)Cl

DOS

IR

Vibrations