Geometry & MOs

Info

ID:	202719
PubChem CID:	79714986
Reduced:	BrON2C15H21 (1)
Stoich.:	ABC2D15E21 (1)
Weight, g/mol:	265.161269
ΔH_f, kcal/mol:	-55.11
Dipole, Da:	2.53
IP(EA), eV:	-8.9(-0.51)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(2-methyl-1,3-thiazol-5-yl)methyl]-N-(piperidin-4-ylmethyl)cyclopropanamine

Drug info:

PubChemData

Smile

CC1CCCC(C1C)NC(=O)C2=C(C=C(C=C2)Br)N

DOS

IR

Vibrations