Geometry & MOs

Info

ID:	195580
PubChem CID:	78704288
Reduced:	OF2S2N3C17H25 (1)
Stoich.:	AB2C2D3E17F25 (1)
Weight, g/mol:	250.168128
ΔH_f, kcal/mol:	-123.83
Dipole, Da:	8.4
IP(EA), eV:	-8.75(-0.84)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(5-tert-butyl-2-methoxyanilino)propanamide

Drug info:

PubChemData

Smile

CC(C)CN1CCOC(C1)CNC(=S)NC2=CC=C(C=C2)SC(F)F

DOS

IR

Vibrations