Geometry & MOs

Info

ID:	70101
PubChem CID:	47207643
Reduced:	NSO4C14H19 (1)
Stoich.:	ABC4D14E19 (1)
Weight, g/mol:	299.119129
ΔH_f, kcal/mol:	-136.31
Dipole, Da:	4.76
IP(EA), eV:	-9.05(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butyl-2-[(3-methoxyphenyl)methylsulfonyl]acetamide

Drug info:

PubChemData

Smile

COC1=CC=CC(=C1)CS(=O)(=O)CCC(=O)NC2CC2

DOS

IR

Vibrations