Geometry & MOs

Info

ID:	139595
PubChem CID:	52567274
Reduced:	SN3O4C23H31 (1)
Stoich.:	AB3C4D23E31 (1)
Weight, g/mol:	376.09806
ΔH_f, kcal/mol:	-137.53
Dipole, Da:	6.3
IP(EA), eV:	-8.68(-0.47)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 3-(2-methoxy-4-prop-2-enylphenoxy)sulfonyl-4-methylbenzoate

Drug info:

PubChemData

Smile

CCN1CCN(CC1)S(=O)(=O)C2=CC=CC(=C2)NC(=O)CCOC3=CC(=C(C=C3)C)C

DOS

IR

Vibrations