Geometry & MOs

Info

ID:	345353
PubChem CID:	127269653
Reduced:	FO2N3C22H26 (1)
Stoich.:	AB2C3D22E26 (1)
Weight, g/mol:	312.147393
ΔH_f, kcal/mol:	-101.76
Dipole, Da:	3.53
IP(EA), eV:	-8.2(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(3,4-dihydro-2H-chromen-6-yl)-3-(4,5,6,7-tetrahydro-1-benzofuran-4-yl)urea

Drug info:

PubChemData

Smile

C1CC2=C(C=CC(=C2)NC(=O)NC3CCN(CC3)CC4=CC=C(C=C4)F)OC1

DOS

IR

Vibrations