Geometry & MOs

Info

ID:	263691
PubChem CID:	103389810
Reduced:	O2N3C17H23 (1)
Stoich.:	A2B3C17D23 (1)
Weight, g/mol:	216.183778
ΔH_f, kcal/mol:	-76.2
Dipole, Da:	2.49
IP(EA), eV:	-8.49(-0.65)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

2-[(5-amino-1-methoxypentan-2-yl)amino]-1-cyclopropylethanol

Drug info:

PubChemData

Smile

CC(CNC(=O)OC(C)(C)C)NC1=CC2=C(C=C1)N=CC=C2

DOS

IR

Vibrations