Geometry & MOs

Info

ID:	281446
PubChem CID:	103913890
Reduced:	SN2O4C13H28 (1)
Stoich.:	AB2C4D13E28 (1)
Weight, g/mol:	282.205576
ΔH_f, kcal/mol:	-220.4
Dipole, Da:	5.98
IP(EA), eV:	-9.23(0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[3-[1-(1-methylimidazol-2-yl)ethylamino]propyl]carbamate

Drug info:

PubChemData

Smile

CCS(=O)(=O)CC(C)NCCCNC(=O)OC(C)(C)C

DOS

IR

Vibrations