Geometry & MOs

Info

ID:	413062
PubChem CID:	135086006
Reduced:	NSO9C25H25 (1)
Stoich.:	ABC9D25E25 (1)
Weight, g/mol:	376.9449
ΔH_f, kcal/mol:	-307.56
Dipole, Da:	6.93
IP(EA), eV:	-8.77(-0.87)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 1-(5,6-dibromopyridin-3-yl)cyclopropane-1-carboxylate

Drug info:

PubChemData

Smile

CCOC(=O)C(=O)C(C1=CN(C2=CC=CC=C21)S(=O)(=O)C3=CC=C(C=C3)C)C(C(=O)OC)C(=O)OC

DOS

IR

Vibrations