Geometry & MOs

Info

ID:	80067
PubChem CID:	49832647
Reduced:	N5O6C16H17 (1)
Stoich.:	A5B6C16D17 (1)
Weight, g/mol:	380.130697
ΔH_f, kcal/mol:	-47.15
Dipole, Da:	7.8
IP(EA), eV:	-9.25(-1.66)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[6-[(7-methyl-[1,3]thiazolo[4,5-b]pyridin-2-yl)oxy]-1H-indol-3-yl]methyl]morpholine

Drug info:

PubChemData

Smile

CC(C1=CC(=C(C=C1[N+](=O)[O-])OCCCN=[N+]=[N-])OC)N2C(=O)C=CC2=O

DOS

IR

Vibrations