Geometry & MOs

Info

ID:	363201
PubChem CID:	127310341
Reduced:	ON2C10H14 (2)
Stoich.:	AB2C10D14 (2)
Weight, g/mol:	352.172225
ΔH_f, kcal/mol:	-40.07
Dipole, Da:	6.19
IP(EA), eV:	-8.92(0.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

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

Drug info:

PubChemData

Smile

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

DOS

IR

Vibrations