Geometry & MOs

Info

ID:	256604
PubChem CID:	103140114
Reduced:	NC5H7 (3)
Stoich.:	AB5C7 (3)
Weight, g/mol:	200.188863
ΔH_f, kcal/mol:	39.8
Dipole, Da:	2.88
IP(EA), eV:	-8.71(-0.7)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

1-N-methyl-1-N-[(5-methyloxolan-2-yl)methyl]butane-1,3-diamine

Drug info:

PubChemData

Smile

CC(C)(C)CC(C1=CC=CC2=C1C=NC=C2)NN

DOS

IR

Vibrations