Geometry & MOs

Info

ID:	50881
PubChem CID:	12013471
Reduced:	BCl2H3F6C8 (1)
Stoich.:	AB2C3D6E8 (1)
Weight, g/mol:	162.100442
ΔH_f, kcal/mol:	-368.07
Dipole, Da:	1.5
IP(EA), eV:	-11.15(-1.78)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-butoxy-1-methoxyurea

Drug info:

PubChemData

Smile

B(C1=CC(=CC(=C1)C(F)(F)F)C(F)(F)F)(Cl)Cl

DOS

IR

Vibrations