Geometry & MOs

Info

ID:	246420
PubChem CID:	103059597
Reduced:	SN3C10H17 (1)
Stoich.:	AB3C10D17 (1)
Weight, g/mol:	266.210661
ΔH_f, kcal/mol:	20.3
Dipole, Da:	3.53
IP(EA), eV:	-8.49(-0.33)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-ethyl-3-[[methyl-[(1-methylpyrazol-4-yl)methyl]amino]methyl]oxan-4-amine

Drug info:

PubChemData

Smile

CCCSCC1=CN=C(C=N1)NCC

DOS

IR

Vibrations