Geometry & MOs

Info

ID:	278864
PubChem CID:	103839198
Reduced:	BrON2C12H17 (1)
Stoich.:	ABC2D12E17 (1)
Weight, g/mol:	224.152478
ΔH_f, kcal/mol:	-48.06
Dipole, Da:	2.84
IP(EA), eV:	-9.77(-1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-[(1-cyclopropylcyclopropyl)methyl]-3-(oxolan-3-yl)urea

Drug info:

PubChemData

Smile

CC(C)CC(C)NC(=O)C1=C(N=CC=C1)Br

DOS

IR

Vibrations