Geometry & MOs

Info

ID:	368911
PubChem CID:	127330919
Reduced:	SN3O4C18H27 (1)
Stoich.:	AB3C4D18E27 (1)
Weight, g/mol:	381.205242
ΔH_f, kcal/mol:	-159.15
Dipole, Da:	6.17
IP(EA), eV:	-8.74(-0.09)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

CC(C1=CC=C(C=C1)NC(=O)NCC2CCS(=O)(=O)C2)N3CCOCC3

DOS

IR

Vibrations