Geometry & MOs

Info

ID:	196760
PubChem CID:	78874817
Reduced:	FOSN6H19C21 (1)
Stoich.:	ABCD6E19F21 (1)
Weight, g/mol:	430.128646
ΔH_f, kcal/mol:	34.11
Dipole, Da:	7.1
IP(EA), eV:	-8.98(-1.02)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(4-methoxyphenyl)-2-morpholin-4-ylethyl]-3-[4-(trifluoromethyl)-1,3-thiazol-2-yl]urea

Drug info:

PubChemData

Smile

CC1=C(C=C(C=C1)CC2=CN=C(S2)NC(=O)NCC3=NN=CN3C4=CC=CC=C4)F

DOS

IR

Vibrations