Geometry & MOs

Info

ID:	281449
PubChem CID:	103913893
Reduced:	ON2C8H14 (2)
Stoich.:	AB2C8D14 (2)
Weight, g/mol:	308.176979
ΔH_f, kcal/mol:	-98.93
Dipole, Da:	2.52
IP(EA), eV:	-9.04(0.86)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-methyl-N-[3-(1-methylsulfonylpropan-2-ylamino)propyl]carbamate

Drug info:

PubChemData

Smile

CC(C1=NC=CN1C)NC2CCN(CC2)C(=O)OC(C)(C)C

DOS

IR

Vibrations