Geometry & MOs

Info

ID:	346736
PubChem CID:	127271240
Reduced:	O3N4C19H36 (1)
Stoich.:	A3B4C19D36 (1)
Weight, g/mol:	381.206385
ΔH_f, kcal/mol:	-172.2
Dipole, Da:	2.8
IP(EA), eV:	-8.53(0.89)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(6-fluoro-4H-1,3-benzodioxin-8-yl)methyl]-3-(3-methyl-2-morpholin-4-ylbutyl)urea

Drug info:

PubChemData

Smile

CC1CCCCN1C(=O)C(C)NC(=O)NCC(C(C)C)N2CCOCC2

DOS

IR

Vibrations