Geometry & MOs

Info

ID:	448381
PubChem CID:	135290502
Reduced:	N2O3C21H24 (1)
Stoich.:	A2B3C21D24 (1)
Weight, g/mol:	433.197964
ΔH_f, kcal/mol:	-73.4
Dipole, Da:	4.32
IP(EA), eV:	-8.87(-0.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

propan-2-yl 2-(3-chloro-4,5-dihydro-1,2-oxazol-5-yl)-2-[[4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoyl]amino]acetate

Drug info:

PubChemData

Smile

COC1=C(C=CC(=C1)C(=O)N2CCC(CC2)N3CC4=CC=CC=C4C3)O

DOS

IR

Vibrations