Geometry & MOs

Info

ID:	58830
PubChem CID:	24714922
Reduced:	ON4C19H28 (1)
Stoich.:	AB4C19D28 (1)
Weight, g/mol:	312.195011
ΔH_f, kcal/mol:	30.75
Dipole, Da:	2.88
IP(EA), eV:	-8.59(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[5-(4-methylpiperazin-1-yl)-3-phenyl-1,2-oxazol-4-yl]methyl]cyclopropanamine

Drug info:

PubChemData

Smile

CCC(C)NCC1=C(ON=C1C2=CC=CC=C2)N3CCN(CC3)C

DOS

IR

Vibrations