Geometry & MOs

Info

ID:	266104
PubChem CID:	103558410
Reduced:	BrNO2C13H16 (1)
Stoich.:	ABC2D13E16 (1)
Weight, g/mol:	201.111341
ΔH_f, kcal/mol:	-56.65
Dipole, Da:	4.63
IP(EA), eV:	-9.01(-0.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

[[2-(1-methoxycyclobutyl)acetyl]amino]urea

Drug info:

PubChemData

Smile

COC1(CCC1)CC(=O)C2=C(C=C(C=C2)N)Br

DOS

IR

Vibrations