Geometry & MOs

Info

ID:	134818
PubChem CID:	51763312
Reduced:	N2O3C32H44 (1)
Stoich.:	A2B3C32D44 (1)
Weight, g/mol:	382.355929
ΔH_f, kcal/mol:	-138.19
Dipole, Da:	6.95
IP(EA), eV:	-8.96(-0.81)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-N-tert-butyl-2-[hexanoyl(hexyl)amino]heptanamide

Drug info:

PubChemData

Smile

CCCCCCN([C@H](C1=CC2=CC=CC=C2C3=CC=CC=C31)C(=O)NC(C)(C)CC(C)(C)C)C(=O)CO

DOS

IR

Vibrations