Geometry & MOs

Info

ID:	206966
PubChem CID:	80326074
Reduced:	SO2N3C15H23 (1)
Stoich.:	AB2C3D15E23 (1)
Weight, g/mol:	320.111398
ΔH_f, kcal/mol:	-90.63
Dipole, Da:	1.73
IP(EA), eV:	-8.91(-0.23)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[2-[(3-chlorophenyl)methyl]-3-(4-methyl-1,3-thiazol-2-yl)propyl]cyclopropanamine

Drug info:

PubChemData

Smile

CCC1(C(=O)N(C(C(=O)N1)(C)C)CC2=NC(=CS2)C)CC

DOS

IR

Vibrations