Geometry & MOs

Info

ID:	64042
PubChem CID:	26759744
Reduced:	N2S3O4C21H24 (1)
Stoich.:	A2B3C4D21E24 (1)
Weight, g/mol:	360.132136
ΔH_f, kcal/mol:	-111.13
Dipole, Da:	9.65
IP(EA), eV:	-9.05(-0.92)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[(2S)-1-(furan-2-ylmethylcarbamoylamino)-1-oxopropan-2-yl] 2-(4-methoxyphenyl)acetate

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)NC(=O)C2=CC=C(C=C2)C3SCCS3)S(=O)(=O)N4CCOCC4

DOS

IR

Vibrations