Geometry & MOs

Info

ID:	313552
PubChem CID:	126615866
Reduced:	O6C7H16 (1)
Stoich.:	A6B7C16 (1)
Weight, g/mol:	217.08678
ΔH_f, kcal/mol:	-216.67
Dipole, Da:	1.37
IP(EA), eV:	-9.45(0.1)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

ethyl 5-(phosphanylamino)-2,3,6,7-tetrahydrooxepine-4-carboxylate

Drug info:

PubChemData

Smile

CC(C(O)(O)OC)OCCOOC

DOS

IR

Vibrations