Geometry & MOs

Info

ID:	233551
PubChem CID:	91145437
Reduced:	N3O4H23C27 (1)
Stoich.:	A3B4C23D27 (1)
Weight, g/mol:	348.104084
ΔH_f, kcal/mol:	-29.64
Dipole, Da:	3.08
IP(EA), eV:	-8.81(-0.93)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(4-chlorophenyl)-3-[(4R)-6-fluoro-2,2-dimethyl-3,4-dihydrochromen-4-yl]urea

Drug info:

PubChemData

Smile

COC(=O)C1=CC=C(C=C1)C=CNC(=O)COC2=NNC(=C2C3=CC=CC=C3)C4=CC=CC=C4

DOS

IR

Vibrations