Geometry & MOs

Info

ID:	281893
PubChem CID:	103914506
Reduced:	NSO3C12H25 (1)
Stoich.:	ABC3D12E25 (1)
Weight, g/mol:	237.184112
ΔH_f, kcal/mol:	-161.7
Dipole, Da:	6.8
IP(EA), eV:	-9.23(0.83)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-(1-methylimidazol-2-yl)-N-[(4-methyloxan-4-yl)methyl]ethanamine

Drug info:

PubChemData

Smile

CCS(=O)(=O)CC(C)NCC1(CCOCC1)C

DOS

IR

Vibrations