Geometry & MOs

Info

ID:	167761
PubChem CID:	74870619
Reduced:	ClN3C17H20 (1)
Stoich.:	AB3C17D20 (1)
Weight, g/mol:	277.215413
ΔH_f, kcal/mol:	43.57
Dipole, Da:	3.12
IP(EA), eV:	-8.99(-0.15)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-(3-methoxy-4-methylphenyl)-5-pentan-3-ylpyrazolidin-3-amine

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)C2C(C(NN2)N)C3=CC=C(C=C3)Cl)C

DOS

IR

Vibrations