Geometry & MOs

Info

ID:	354537
PubChem CID:	127287151
Reduced:	O2N6C17H30 (1)
Stoich.:	A2B6C17D30 (1)
Weight, g/mol:	269.148789
ΔH_f, kcal/mol:	-38.46
Dipole, Da:	4.35
IP(EA), eV:	-8.72(-0.56)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(4-methylmorpholin-2-yl)methyl]-3-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]urea

Drug info:

PubChemData

Smile

CC1CCC(N1CCN2CCN(CC2)C(=O)NCC3=NC(=NO3)C)C

DOS

IR

Vibrations