Geometry & MOs

Info

ID:	271153
PubChem CID:	103645538
Reduced:	O3N4C16H26 (1)
Stoich.:	A3B4C16D26 (1)
Weight, g/mol:	304.178693
ΔH_f, kcal/mol:	-103.26
Dipole, Da:	3.74
IP(EA), eV:	-8.53(-0.12)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

tert-butyl 3-(3,4-dihydro-2H-chromen-4-ylamino)azetidine-1-carboxylate

Drug info:

PubChemData

Smile

CC(C)(C)OC(=O)N1CC(C1)NC2=C(C=CN=C2OC)N(C)C

DOS

IR

Vibrations