Geometry & MOs

Info

ID:	216679
PubChem CID:	85086598
Reduced:	ON5H13C16 (1)
Stoich.:	AB5C13D16 (1)
Weight, g/mol:	291.168188
ΔH_f, kcal/mol:	113.44
Dipole, Da:	4.12
IP(EA), eV:	-7.98(-1.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[6-[2-(dimethylamino)ethoxy]-2,2-dimethyl-3a,5,6,6a-tetrahydrofuro[2,3-d][1,3]dioxol-5-yl]ethane-1,2-diol

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)NC2=NNC(=C3C(=C4C=CC=CC4=N3)N)O2

DOS

IR

Vibrations