Geometry & MOs

Info

ID:	214188
PubChem CID:	81087290
Reduced:	NOC6H12 (2)
Stoich.:	ABC6D12 (2)
Weight, g/mol:	216.183778
ΔH_f, kcal/mol:	-115.8
Dipole, Da:	4.42
IP(EA), eV:	-9.35(1.29)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

4-amino-N-(3-hydroxypropyl)-3-methyl-N-propan-2-ylbutanamide

Drug info:

PubChemData

Smile

CCN(CC1CCOC1)C(=O)CC(C)CN

DOS

IR

Vibrations