Geometry & MOs

Info

ID:	152901
PubChem CID:	56311989
Reduced:	SO3N4C24H32 (1)
Stoich.:	AB3C4D24E32 (1)
Weight, g/mol:	330.174356
ΔH_f, kcal/mol:	-102.45
Dipole, Da:	3.16
IP(EA), eV:	-8.29(-0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(4-fluoro-N-propan-2-ylanilino)-N-[(2-methoxyphenyl)methyl]acetamide

Drug info:

PubChemData

Smile

CCCC(C)NC(=O)C1CCCN(C1)CC(=O)NC2=CC=C(C=C2)NC(=O)C3=CC=CS3

DOS

IR

Vibrations