Geometry & MOs

Info

ID:	159269
PubChem CID:	57269388
Reduced:	NSO5C25H25 (1)
Stoich.:	ABC5D25E25 (1)
Weight, g/mol:	214.240899
ΔH_f, kcal/mol:	-126.73
Dipole, Da:	6.62
IP(EA), eV:	-9.0(-0.71)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N'-propan-2-yl-N,N'-dipropylbutane-1,4-diamine

Drug info:

PubChemData

Smile

C1=CC=C(C=C1)CCCCCC(C(=O)O)N(C2=CC3=C(C=C2)OC4=CC=CC=C43)S(=O)O

DOS

IR

Vibrations