Geometry & MOs

Info

ID:	255308
PubChem CID:	103131304
Reduced:	NC3H4 (4)
Stoich.:	AB3C4 (4)
Weight, g/mol:	283.01204
ΔH_f, kcal/mol:	62.73
Dipole, Da:	4.28
IP(EA), eV:	-9.11(0.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3-bromo-4-fluorophenyl)-(1-methylpyrazol-3-yl)methanamine

Drug info:

PubChemData

Smile

CCC1=C(N=CC=C1)C(C2=NN(C=C2)C)N

DOS

IR

Vibrations