Geometry & MOs

Info

ID:	214166
PubChem CID:	81087178
Reduced:	NOC6H13 (2)
Stoich.:	ABC6D13 (2)
Weight, g/mol:	244.178693
ΔH_f, kcal/mol:	-121.46
Dipole, Da:	1.95
IP(EA), eV:	-9.16(1.54)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

methyl 2-[3-(aminomethyl)pentanoyl-propan-2-ylamino]acetate

Drug info:

PubChemData

Smile

CCC(CC(=O)N(CC)C(C)COC)CN

DOS

IR

Vibrations