Geometry & MOs

Info

ID:	266303
PubChem CID:	103562472
Reduced:	BrN3C11H18 (1)
Stoich.:	AB3C11D18 (1)
Weight, g/mol:	243.03711
ΔH_f, kcal/mol:	21.27
Dipole, Da:	2.61
IP(EA), eV:	-8.88(0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-bromo-5-methyl-2-(3-methylcyclobutyl)pyrazol-3-amine

Drug info:

PubChemData

Smile

CC1=NN(C(=C1Br)N)C2CC(C2)C(C)C

DOS

IR

Vibrations