Geometry & MOs

Info

ID:	274634
PubChem CID:	103810731
Reduced:	O2N3C16H27 (1)
Stoich.:	A2B3C16D27 (1)
Weight, g/mol:	202.168128
ΔH_f, kcal/mol:	-97.78
Dipole, Da:	2.23
IP(EA), eV:	-9.15(0.07)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

3-amino-N-(1-hydroxy-4-methylpentan-3-yl)butanamide

Drug info:

PubChemData

Smile

CC(C)C(CCO)NC(=O)C1=CC=CN1C2CCNCC2

DOS

IR

Vibrations