Geometry & MOs

Info

ID:	411257
PubChem CID:	135084070
Reduced:	SeN2O5C10H14 (1)
Stoich.:	AB2C5D10E14 (1)
Weight, g/mol:	144.11503
ΔH_f, kcal/mol:	-211.22
Dipole, Da:	3.59
IP(EA), eV:	-9.62(-1.18)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(E,3S)-1-methoxyhept-1-en-3-ol

Drug info:

PubChemData

Smile

CC1=CN(C(=O)NC1=O)[C@H]2C(C([C@H]([Se]2)CO)O)O

DOS

IR

Vibrations