Geometry & MOs

Info

ID:	263660
PubChem CID:	103387432
Reduced:	N3O3C17H37 (1)
Stoich.:	A3B3C17D37 (1)
Weight, g/mol:	206.178299
ΔH_f, kcal/mol:	-185.25
Dipole, Da:	2.42
IP(EA), eV:	-8.66(1.03)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-N-(4-phenylbutan-2-yl)propane-1,2-diamine

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)NCCCC(COC)NCC(C)(C)N(C)C

DOS

IR

Vibrations