Geometry & MOs

Info

ID:	344058
PubChem CID:	127267234
Reduced:	ON2C9H12 (2)
Stoich.:	AB2C9D12 (2)
Weight, g/mol:	280.169939
ΔH_f, kcal/mol:	-29.65
Dipole, Da:	5.62
IP(EA), eV:	-8.87(-0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[2-(2,2-dimethylpyrrolidin-1-yl)ethyl]-3-(5-fluoropyridin-2-yl)urea

Drug info:

PubChemData

Smile

CC1=NN(C(=C1)NC(=O)NC(C2=CC=CC=C2)C3(CCC3)CO)C

DOS

IR

Vibrations