Geometry & MOs

Info

ID:	435846
PubChem CID:	135192565
Reduced:	NO3C21H35 (1)
Stoich.:	AB3C21D35 (1)
Weight, g/mol:	270.303499
ΔH_f, kcal/mol:	-168.39
Dipole, Da:	2.93
IP(EA), eV:	-9.02(0.34)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-butyl-N,N'-dimethyl-N'-pentylhexane-1,6-diamine

Drug info:

PubChemData

Smile

CCC(C)(C1=CC=C(C=C1)CCOC(=O)C(C)(CC(C)(C)C)NC)O

DOS

IR

Vibrations