Geometry & MOs

Info

ID:	263703
PubChem CID:	103391063
Reduced:	SN2O2C10H24 (1)
Stoich.:	AB2C2D10E24 (1)
Weight, g/mol:	318.251858
ΔH_f, kcal/mol:	-86.41
Dipole, Da:	3.37
IP(EA), eV:	-8.38(0.88)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[4-(1-hydroxypentan-3-ylamino)-5-methoxypentyl]carbamate

Drug info:

PubChemData

Smile

CCS(=O)CCNC(CCCN)COC

DOS

IR

Vibrations