Geometry & MOs

Info

ID:	349601
PubChem CID:	127275753
Reduced:	NO2C6H11 (2)
Stoich.:	AB2C6D11 (2)
Weight, g/mol:	308.153621
ΔH_f, kcal/mol:	-183.76
Dipole, Da:	3.34
IP(EA), eV:	-9.35(0.99)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC1CN(CCCO1)C(=O)NCC2COCCO2

DOS

IR

Vibrations