Geometry & MOs

Info

ID:	345927
PubChem CID:	127270227
Reduced:	FO2N4C19H27 (1)
Stoich.:	AB2C4D19E27 (1)
Weight, g/mol:	376.227454
ΔH_f, kcal/mol:	-128.97
Dipole, Da:	8.2
IP(EA), eV:	-8.88(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[1-[1-(azepan-1-yl)-1-oxopropan-2-yl]pyrrolidin-3-yl]-3-(4-fluorophenyl)urea

Drug info:

PubChemData

Smile

C1CCN(CC1)C(=O)CCN2CCC(C2)NC(=O)NC3=CC=C(C=C3)F

DOS

IR

Vibrations