Geometry & MOs

Info

ID:	276497
PubChem CID:	103823834
Reduced:	BrN3O3C15H18 (1)
Stoich.:	AB3C3D15E18 (1)
Weight, g/mol:	263.163377
ΔH_f, kcal/mol:	-79.36
Dipole, Da:	3.78
IP(EA), eV:	-8.36(-0.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[5-(cyclopropylmethylamino)pyridin-2-yl]carbamate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NC1=NC=C(C=C1)NCC2=C(C=CO2)Br

DOS

IR

Vibrations