Geometry & MOs

Info

ID:	278093
PubChem CID:	103833307
Reduced:	O2N3C12H25 (1)
Stoich.:	A2B3C12D25 (1)
Weight, g/mol:	242.199428
ΔH_f, kcal/mol:	-120.6
Dipole, Da:	3.76
IP(EA), eV:	-9.3(1.0)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(2S)-2-amino-3-methyl-N-[(4-methyloxan-4-yl)methyl]pentanamide

Drug info:

PubChemData

Smile

CCC(C)[C@@H](C(=O)N(C)CC(C)C(=O)NC)N

DOS

IR

Vibrations