Geometry & MOs

Info

ID:	368913
PubChem CID:	127330921
Reduced:	ON2C11H18 (2)
Stoich.:	AB2C11D18 (2)
Weight, g/mol:	399.19582
ΔH_f, kcal/mol:	-92.44
Dipole, Da:	6.06
IP(EA), eV:	-8.44(0.35)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(6-fluoro-3,4-dihydro-2H-chromen-4-yl)-3-[4-(1-morpholin-4-ylethyl)phenyl]urea

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)NC(=O)NCC(C)(C)N2CCCCC2)N3CCOCC3

DOS

IR

Vibrations