Geometry & MOs

Info

ID:	345367
PubChem CID:	127269667
Reduced:	N3O3C21H23 (1)
Stoich.:	A3B3C21D23 (1)
Weight, g/mol:	318.194343
ΔH_f, kcal/mol:	-85.88
Dipole, Da:	5.56
IP(EA), eV:	-8.24(-0.04)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

C1CC2=CC=CC=C2N(C1)C(=O)CNC(=O)NC3=CC4=C(C=C3)OCCC4

DOS

IR

Vibrations