Geometry & MOs

Info

ID:	254216
PubChem CID:	103123470
Reduced:	ON5C15H19 (1)
Stoich.:	AB5C15D19 (1)
Weight, g/mol:	246.148061
ΔH_f, kcal/mol:	53.74
Dipole, Da:	3.16
IP(EA), eV:	-8.89(-1.27)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[3-[5-(1-methylpyrazol-3-yl)-1,3-oxazol-2-yl]propyl]cyclopropanamine

Drug info:

PubChemData

Smile

CC(C)NCCCC1=NC=C(O1)C2=C3C=NC=CN3N=C2

DOS

IR

Vibrations