Geometry & MOs

Info

ID:	204057
PubChem CID:	79906418
Reduced:	O2N3C14H27 (1)
Stoich.:	A2B3C14D27 (1)
Weight, g/mol:	307.171834
ΔH_f, kcal/mol:	-61.62
Dipole, Da:	1.89
IP(EA), eV:	-8.64(0.8)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[[1-(1-oxa-9-thiaspiro[5.5]undecan-4-yl)pyrazol-3-yl]methyl]cyclopropanamine

Drug info:

PubChemData

Smile

CCN(CC(C)C(=NO)N)C1CCOC2(C1)CCC2

DOS

IR

Vibrations