Geometry & MOs

Info

ID:	16348
PubChem CID:	465040
Reduced:	ClN2O2C16H25 (1)
Stoich.:	AB2C2D16E25 (1)
Weight, g/mol:	312.160456
ΔH_f, kcal/mol:	-91.03
Dipole, Da:	2.71
IP(EA), eV:	-10.43(-1.63)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

undecan-2-yl 5-chloropyrazine-2-carboxylate

Drug info:

PubChemData

Smile

CCCCCCCCCC(C)OC(=O)C1=CN=C(C=N1)Cl

DOS

IR

Vibrations