Geometry & MOs

Info

ID:	194405
PubChem CID:	78531097
Reduced:	NO3C22H23 (1)
Stoich.:	AB3C22D23 (1)
Weight, g/mol:	377.129694
ΔH_f, kcal/mol:	-72.63
Dipole, Da:	1.81
IP(EA), eV:	-9.27(-0.72)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-[cyclopropyl-(1,1-dioxothiolan-3-yl)amino]-2-oxoethyl] 3-(4-methylphenyl)prop-2-enoate

Drug info:

PubChemData

Smile

CC1=CC=C(C=C1)C=CC(=O)OC(C2=CC=CC=C2)C(=O)N3CCCC3

DOS

IR

Vibrations