Geometry & MOs

Info

ID:	279937
PubChem CID:	103845810
Reduced:	O2N3C13H27 (1)
Stoich.:	A2B3C13D27 (1)
Weight, g/mol:	282.205576
ΔH_f, kcal/mol:	-112.95
Dipole, Da:	5.38
IP(EA), eV:	-9.03(0.97)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[3-[2-(4-methylpyrazol-1-yl)ethylamino]propyl]carbamate

Drug info:

PubChemData

Smile

CCCN(CC)CCNC(=O)C1(CCOCC1)N

DOS

IR

Vibrations