Geometry & MOs

Info

ID:	14931
PubChem CID:	424488
Reduced:	NO4C12H21 (1)
Stoich.:	AB4C12D21 (1)
Weight, g/mol:	243.147058
ΔH_f, kcal/mol:	-172.92
Dipole, Da:	1.48
IP(EA), eV:	-9.15(1.06)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

N-[(4-methoxy-2,2-dimethyl-3a,4,6,6a-tetrahydrofuro[3,4-d][1,3]dioxol-6-yl)methyl]prop-2-en-1-amine

Drug info:

PubChemData

Smile

CC1(OC2C(OC(C2O1)OC)CNCC=C)C

DOS

IR

Vibrations