Geometry & MOs

Info

ID:	280083
PubChem CID:	103846735
Reduced:	SN3O3C16H27 (1)
Stoich.:	AB3C3D16E27 (1)
Weight, g/mol:	322.225643
ΔH_f, kcal/mol:	-141.1
Dipole, Da:	3.07
IP(EA), eV:	-9.22(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl N-[2-[(4-methoxyphenyl)methylamino]ethyl]-N-propylcarbamate

Drug info:

PubChemData

Smile

CCCN(CCNCC1=CC(=CS1)C(=O)N)C(=O)OC(C)(C)C

DOS

IR

Vibrations