Geometry & MOs

Info

ID:	431627
PubChem CID:	135171723
Reduced:	O8N11C32H43 (1)
Stoich.:	A8B11C32D43 (1)
Weight, g/mol:	308.319149
ΔH_f, kcal/mol:	-201.48
Dipole, Da:	5.05
IP(EA), eV:	-9.03(-1.45)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N'-(4-methyloctan-4-yl)-1-N-(2,4,5-trimethylhex-1-en-3-yl)ethene-1,1-diamine

Drug info:

PubChemData

Smile

CCC1=CN(N=N1)CCOCCOCCOCCNC(=O)CC[C@@H](C(=O)O)NC(=O)C2=CC=C(C=C2)NCC3=CN=C4C(=N3)C(=O)N=C(N4)NC

DOS

IR

Vibrations