Geometry & MOs

Info

ID:	345351
PubChem CID:	127269651
Reduced:	ON2C8H9 (2)
Stoich.:	AB2C8D9 (2)
Weight, g/mol:	292.142307
ΔH_f, kcal/mol:	-35.88
Dipole, Da:	1.06
IP(EA), eV:	-8.36(-0.49)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,4-dihydro-2H-chromen-6-yl)-3-(1,4-dioxan-2-ylmethyl)urea

Drug info:

PubChemData

Smile

CC1=NC=CC(=N1)CNC(=O)NC2=CC3=C(C=C2)OCCC3

DOS

IR

Vibrations