Geometry & MOs

Info

ID:	352218
PubChem CID:	127283300
Reduced:	N2O3C17H24 (1)
Stoich.:	A2B3C17D24 (1)
Weight, g/mol:	322.169271
ΔH_f, kcal/mol:	-106.53
Dipole, Da:	3.23
IP(EA), eV:	-9.43(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[cyclobutyl-(4-fluorophenyl)methyl]-3-(1,4-dioxan-2-ylmethyl)urea

Drug info:

PubChemData

Smile

C1CC(C1)C(C2=CC=CC=C2)NC(=O)NCC3COCCO3

DOS

IR

Vibrations