Geometry & MOs

Info

ID:	130946
PubChem CID:	51133113
Reduced:	O2N4H18C19 (1)
Stoich.:	A2B4C18D19 (1)
Weight, g/mol:	339.114044
ΔH_f, kcal/mol:	3.31
Dipole, Da:	2.26
IP(EA), eV:	-8.48(-0.59)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

cyclopropylmethyl 2-[(2-propylsulfonylbenzoyl)amino]acetate

Drug info:

PubChemData

Smile

CC1=CC=CC=C1N2C3=C(CCC3)C(=N2)C(=O)NC4=CC=CNC4=O

DOS

IR

Vibrations