Geometry & MOs

Info

ID:	27426
PubChem CID:	821306
Reduced:	OC7H11 (2)
Stoich.:	AB7C11 (2)
Weight, g/mol:	282.136828
ΔH_f, kcal/mol:	-92.87
Dipole, Da:	4.01
IP(EA), eV:	-9.57(0.55)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-(N-acetylanilino)-N-(4-methylphenyl)acetamide

Drug info:

PubChemData

Smile

C[C@H]1CC[C@]2([C@@H]1[C@H]3[C@H](C3(C)C)CCC2=O)O

DOS

IR

Vibrations