Geometry & MOs

Info

ID:	367268
PubChem CID:	127324045
Reduced:	OF3N6C16H25 (1)
Stoich.:	AB3C6D16E25 (1)
Weight, g/mol:	277.19026
ΔH_f, kcal/mol:	-185.29
Dipole, Da:	4.32
IP(EA), eV:	-9.59(0.42)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-cyclopropylpyrrolidin-3-yl)methyl]-3-(2-pyrazol-1-ylethyl)urea

Drug info:

PubChemData

Smile

CCC1=NN2CC(CCC2=N1)NC(=O)NCC3CCN(C3)CC(F)(F)F

DOS

IR

Vibrations