Geometry & MOs

Info

ID:	285688
PubChem CID:	104119019
Reduced:	NOC6H11 (2)
Stoich.:	ABC6D11 (2)
Weight, g/mol:	208.121178
ΔH_f, kcal/mol:	-77.35
Dipole, Da:	2.63
IP(EA), eV:	-8.97(0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[2-(cyclopropylmethoxy)-1,3-oxazol-4-yl]methyl]cyclopropanamine

Drug info:

PubChemData

Smile

CCNCC1=COC(=N1)OC(C)CC(C)C

DOS

IR

Vibrations