Geometry & MOs

Info

ID:	388512
PubChem CID:	134989358
Reduced:	BrNSO3C7H12 (1)
Stoich.:	ABCD3E7F12 (1)
Weight, g/mol:	164.063701
ΔH_f, kcal/mol:	-150.11
Dipole, Da:	2.21
IP(EA), eV:	-9.42(-1.94)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

dilithium;3-methoxybenzene-4-ide-1-carboxylate

Drug info:

PubChemData

Smile

CC1(N(C(C(S1)O)C(=O)OC)Br)C

DOS

IR

Vibrations