Geometry & MOs

Info

ID:	223570
PubChem CID:	85335251
Reduced:	O2N7C23H33 (1)
Stoich.:	A2B7C23D33 (1)
Weight, g/mol:	436.122356
ΔH_f, kcal/mol:	-14.51
Dipole, Da:	5.23
IP(EA), eV:	-8.37(-0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(4-acetylphenyl)methyl-(4-chlorophenyl)sulfonylamino]-4-methylpentanamide

Drug info:

PubChemData

Smile

CCN(CC)CCCOC1=NC=C(C=C1)NC(=O)C2C3C(CCC4=CN=C(N=C34)C)NN2

DOS

IR

Vibrations