Geometry & MOs

Info

ID:	186046
PubChem CID:	77383800
Reduced:	N2O3C33H42 (1)
Stoich.:	A2B3C33D42 (1)
Weight, g/mol:	418.185235
ΔH_f, kcal/mol:	-81.03
Dipole, Da:	2.37
IP(EA), eV:	-8.91(-0.76)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

6-hydroxy-5-[6-[2-(2-hydroxyethoxy)ethoxy]-2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indol-1-yl]-1-methyl-1,3-diazinane-2,4-dione

Drug info:

PubChemData

Smile

CCC=CCCCCOC1=CC=C(C=C1)C(=O)OC2=CC=C(C=C2)C3=NC=C(C=N3)CCCCC(C)CC

DOS

IR

Vibrations