Geometry & MOs

Info

ID:

364177

PubChem CID:

127314473

Reduced:

O3N4C18H32 (1)

Stoich.:

A3B4C18D32 (1)

Weight, g/mol:

306.174356

ΔHf, kcal/mol:

-139.26

Dipole, Da:

7.22

IP(EA), eV:

-9.25(0.77)

Spin(Sz, S2):

None, None

Charge, e:

0

Chem-info

IUPAC name:

1-[[1-(4-fluorophenyl)cyclobutyl]methyl]-3-[(3-methyloxetan-3-yl)methyl]urea

Drug info:

PubChemData

Smile

CC(C(=O)NC1CCCC1)N2CCN(CC2)C(=O)NCC3(COC3)C

DOS

IR

Vibrations