Geometry & MOs

Info

ID:	150685
PubChem CID:	53790379
Reduced:	NO6C18H25 (1)
Stoich.:	AB6C18D25 (1)
Weight, g/mol:	589.20603
ΔH_f, kcal/mol:	-148.18
Dipole, Da:	4.96
IP(EA), eV:	-10.1(-1.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2,5-dihydroxypyrrol-1-yl) 4-[bis(4-methoxyphenyl)methylamino]-4-oxo-2-(phenylmethoxycarbonylamino)butanoate

Drug info:

PubChemData

Smile

CCCOC(=O)C1(CO1)CCCOCCCC2=CC=C(C=C2)[N+](=O)[O-]

DOS

IR

Vibrations