Geometry & MOs

Info

ID:	254064
PubChem CID:	103122484
Reduced:	BrON4C11H13 (1)
Stoich.:	ABC4D11E13 (1)
Weight, g/mol:	309.04767
ΔH_f, kcal/mol:	28.69
Dipole, Da:	5.59
IP(EA), eV:	-9.68(-1.41)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-(2-bromopropyl)-N,1-dimethylindazole-3-carboxamide

Drug info:

PubChemData

Smile

CC(CN(C)C(=O)C1=C2C=NC=CN2N=C1)Br

DOS

IR

Vibrations