Geometry & MOs

Info

ID:	174178
PubChem CID:	75734823
Reduced:	N2O3C23H38 (1)
Stoich.:	A2B3C23D38 (1)
Weight, g/mol:	502.250144
ΔH_f, kcal/mol:	-162.86
Dipole, Da:	7.19
IP(EA), eV:	-9.16(-0.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-tert-butyl-2-methoxy-N-[1-[(4-methylphenyl)sulfonylmethylamino]-1-oxoheptan-2-yl]benzamide

Drug info:

PubChemData

Smile

CCCCCC(C(=O)NC(C)(C)C)N(C(=O)C1=CC=CC=C1OC)C(C)(C)C

DOS

IR

Vibrations