Geometry & MOs

Info

ID:	77020
PubChem CID:	48425714
Reduced:	BrSN2O2C15H21 (1)
Stoich.:	ABC2D2E15F21 (1)
Weight, g/mol:	354.194343
ΔH_f, kcal/mol:	-69.81
Dipole, Da:	2.86
IP(EA), eV:	-9.07(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(diethylamino)-2-oxoethyl]-3-(2-phenylphenoxy)propanamide

Drug info:

PubChemData

Smile

CCN(CC)C(=O)CNC(=O)CCSC1=CC=CC=C1Br

DOS

IR

Vibrations