Geometry & MOs

Info

ID:	174038
PubChem CID:	75714385
Reduced:	SN2O5C25H32 (1)
Stoich.:	AB2C5D25E32 (1)
Weight, g/mol:	374.256943
ΔH_f, kcal/mol:	-171.3
Dipole, Da:	5.76
IP(EA), eV:	-8.94(-0.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-(butylamino)-1-(3-methoxyphenyl)-2-oxoethyl]-N-methyloct-2-enamide

Drug info:

PubChemData

Smile

CCCCCC=CC(=O)N(C)C(C1=CC=C(C=C1)O)C(=O)NCS(=O)(=O)C2=CC=C(C=C2)C

DOS

IR

Vibrations