Geometry & MOs

Info

ID:	60802
PubChem CID:	26702361
Reduced:	N3O5C25H27 (1)
Stoich.:	A3B5C25D27 (1)
Weight, g/mol:	324.147393
ΔH_f, kcal/mol:	-162.99
Dipole, Da:	4.81
IP(EA), eV:	-8.84(-0.26)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2R)-4-(4-acetylanilino)-4-oxobutan-2-yl]benzamide

Drug info:

PubChemData

Smile

C1C[C@@H](N(C1)C(=O)CNC(=O)C2=CC=C(C=C2)N3CCCC3=O)C4=CC5=C(C=C4)OCCO5

DOS

IR

Vibrations