Geometry & MOs

Info

ID:	57942
PubChem CID:	24398000
Reduced:	SN2O3C23H26 (1)
Stoich.:	AB2C3D23E26 (1)
Weight, g/mol:	327.183444
ΔH_f, kcal/mol:	-89.48
Dipole, Da:	6.7
IP(EA), eV:	-8.5(-1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(4-tert-butylphenyl)-3-(2-methoxyphenoxy)propanamide

Drug info:

PubChemData

Smile

CC(C)(C)C1=CC=C(C=C1)NC(=O)C(CCSC)N2C(=O)C3=CC=CC=C3C2=O

DOS

IR

Vibrations