Geometry & MOs

Info

ID:	16528
PubChem CID:	472073
Reduced:	O2N3C22H39 (1)
Stoich.:	A2B3C22D39 (1)
Weight, g/mol:	377.304228
ΔH_f, kcal/mol:	-102.32
Dipole, Da:	4.65
IP(EA), eV:	-8.15(1.22)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-[[1-hexyl-2,5-dimethyl-4-(morpholin-4-ylmethyl)pyrrol-3-yl]methyl]morpholine

Drug info:

PubChemData

Smile

CCCCCCN1C(=C(C(=C1C)CN2CCOCC2)CN3CCOCC3)C

DOS

IR

Vibrations