Geometry & MOs

Info

ID:	354255
PubChem CID:	127286219
Reduced:	O2N5C17H29 (1)
Stoich.:	A2B5C17D29 (1)
Weight, g/mol:	335.232125
ΔH_f, kcal/mol:	-75.57
Dipole, Da:	6.03
IP(EA), eV:	-8.9(-0.37)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(2-tert-butylpyrimidin-5-yl)-3-[2-(2,2-dimethylmorpholin-4-yl)ethyl]urea

Drug info:

PubChemData

Smile

CC(C(C)N1CCOCC1)NC(=O)NC2=CN=C(N=C2)C(C)(C)C

DOS

IR

Vibrations