Geometry & MOs

Info

ID:	363208
PubChem CID:	127310348
Reduced:	ON3C9H13 (2)
Stoich.:	AB3C9D13 (2)
Weight, g/mol:	352.172225
ΔH_f, kcal/mol:	-18.16
Dipole, Da:	1.91
IP(EA), eV:	-9.18(-0.19)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-morpholin-4-ylpropan-2-yl)-3-[2-oxo-1-(2,2,2-trifluoroethyl)pyrrolidin-3-yl]urea

Drug info:

PubChemData

Smile

CC1=CN(N=C1)CC2CN(CCO2)C(=O)NCC3=C(N=CC=C3)N(C)C

DOS

IR

Vibrations