Geometry & MOs

Info

ID:	446574
PubChem CID:	135276135
Reduced:	OSN7C23H33 (1)
Stoich.:	ABC7D23E33 (1)
Weight, g/mol:	327.114044
ΔH_f, kcal/mol:	8.66
Dipole, Da:	4.27
IP(EA), eV:	-8.4(-0.75)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

5-[2-hydroxyethyl-[2-(2-methoxyethylsulfanyl)ethyl]amino]-3-methylfuro[3,2-b]pyran-7-one

Drug info:

PubChemData

Smile

CC1=NN=C2N1C3=C(C=C(C=C3)N4CCSCC4)N=C2NCCCCNC(=O)CC(C)C

DOS

IR

Vibrations