Geometry & MOs

Info

ID:	188191
PubChem CID:	77679986
Reduced:	NO2H7C8 (1)
Stoich.:	AB2C7D8 (1)
Weight, g/mol:	575.239828
ΔH_f, kcal/mol:	-26.19
Dipole, Da:	3.35
IP(EA), eV:	-9.23(-1.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 3-[2-[[5-[(2-chlorophenyl)methoxycarbonylamino]-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]phenyl]propanoate

Drug info:

PubChemData

Smile

CC1=NC=C2COC=C2C1=O

DOS

IR

Vibrations