Geometry & MOs

Info

ID:	445240
PubChem CID:	135265369
Reduced:	NSO5C24H25 (1)
Stoich.:	ABC5D24E25 (1)
Weight, g/mol:	510.236601
ΔH_f, kcal/mol:	-138.34
Dipole, Da:	1.91
IP(EA), eV:	-8.79(-1.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[2-methoxy-5-[methyl-(2-oxochromen-4-yl)amino]phenyl] 4-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]pentanoate

Drug info:

PubChemData

Smile

CC(C)N(CCOC(=O)C=C)CCOC(=O)C1=C2C(=CC=C1)SC3=CC=CC=C3C2=O

DOS

IR

Vibrations