Geometry & MOs

Info

ID:	300115
PubChem CID:	119526870
Reduced:	ClON6C20H25 (1)
Stoich.:	ABC6D20E25 (1)
Weight, g/mol:	282.149891
ΔH_f, kcal/mol:	28.62
Dipole, Da:	3.52
IP(EA), eV:	-9.46(-1.31)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-amino-2-(4-propan-2-ylphenyl)ethyl]cyclopropanecarboxamide;hydrochloride

Drug info:

PubChemData

Smile

CC(C)C1=CC=C(C=C1)C(CNC(=O)CC2=CC=C(C=C2)N3C=NN=N3)N.Cl

DOS

IR

Vibrations