Geometry & MOs

Info

ID:	438460
PubChem CID:	135228201
Reduced:	N2P2C6O7H10 (1)
Stoich.:	A2B2C6D7E10 (1)
Weight, g/mol:	216.220164
ΔH_f, kcal/mol:	-377.55
Dipole, Da:	2.14
IP(EA), eV:	-9.25(-0.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(3S)-1-(1-amino-3-methylpentan-3-yl)oxy-3-methylpentan-3-amine

Drug info:

PubChemData

Smile

C1=C(C=NC=C1O)NC(P(=O)(O)O)P(=O)(O)O

DOS

IR

Vibrations