Geometry & MOs

Info

ID:	266304
PubChem CID:	103562473
Reduced:	BrN3C9H14 (1)
Stoich.:	AB3C9D14 (1)
Weight, g/mol:	319.05454
ΔH_f, kcal/mol:	31.36
Dipole, Da:	2.41
IP(EA), eV:	-9.1(0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-iodo-5-methyl-2-(3-propan-2-ylcyclobutyl)pyrazol-3-amine

Drug info:

PubChemData

Smile

CC1CC(C1)N2C(=C(C(=N2)C)Br)N

DOS

IR

Vibrations